地拉韦啶、甲磺酸盐

Description

Delavirdine, Mesylate · CAS 147221-93-0 · C23H32N6O6S2. UNII 421105KRQE. Melting Point: MP: 226-228 °C /Delavirdine/.

Identification

CAS Registry Number	147221-93-0
PubChem CID	441386
Molecular formula	C23H32N6O6S2
IUPAC name	methanesulfonic acid;N-[2-[4-[3-(propan-2-ylamino)-2-pyridinyl]piperazine-1-carbonyl]-1H-indol-5-yl]methanesulfonamide
UNII (FDA)	421105KRQE

Computed Descriptors

Molecular Weight	552.7
Hydrogen Bond Donor Count	4
Hydrogen Bond Acceptor Count	10
Rotatable Bond Count	6
Exact Mass	552.18247511
Monoisotopic Mass	552.18247511
Topological Polar Surface Area	182
Heavy Atom Count	37
Formal Charge	0
Complexity	842

Physical & Chemical Properties

Melting Point	MP: 226-228 °C /Delavirdine/

Physical description & handling notes

• White to tan crystalline powder
• Odorless
• In water: 2,942 mg/mL @ pH 1; 295 ug/mL @ pH 2; 0.81 ug/mL @ pH 7
• VP: 2.6X10-15 mm Hg @ 25 °C /Estimated/ /Delavirdine/
• Henry's Law constant = 4.6X10-25 atm-cu m/mol @ 25 °C /Estimated/ /Delavirdine/
• log Kow = 2.34 @ 25 °C /Estimated/ /Delavirdine/

GHS Hazard Classification

Reported hazard statements	H302 (92.9%), H312 (92.9%), H315 (92.9%), H319 (100%), H332 (92.9%), H335 (92.9%)

Documented Uses

• D.L. Romero et al, WO 91 09849 (1991 to Upjohn)
• Breast Feeding; Lactation; Milk, Human; Anti-Infective Agents; Antiviral Agents; Anti-HIV Agents; Anti-Retroviral Agents; Reverse Transcriptase Inhibitors
• Delavirdine is indicated in the treatment of HIV-1 infection in combination with other appropriate antiretroviral therapy. /Included in US product labeling/
• Severe and life-threatening skin reactions, including Stevens-Johnson syndrome and erythema multiforme, have been reported rarely in patients receiving delavirdine; 2 cases of Stevens-Johnson syndrome were reported during postmarketing surveillance. These severe reactions resolved after the drug was discontinued..
• For more Drug Warnings (Complete) data for DELAVIRDINE MESYLATE (26 total), please visit the HSDB record page.
• Inhibitors of reverse transcriptase (RNA-DIRECTED DNA POLYMERASE), an enzyme that synthesizes DNA on an RNA template.

Synonyms

DELAVIRDINE MESYLATE; 147221-93-0; Delavirdine mesilate; Rescriptor; U-90152S; delavirdine methanesulfonate; Delavirdine monomethanesulfonate; 421105KRQE; CHEBI:4379; 1-(3-(Isopropylamino)-2-pyridyl)-4-((5-methanesulfonamidoindol-2-yl)carbonyl)piperazine monomethanesulfonate; DTXSID701017136; 1-[3-(Isopropylamino)-2-pyridyl]-4-[(5-methanesulfonamidoindol-2-yl)carbonyl]piperazine monomethanesulfonate; Mesylate, Delavirdine; RefChem:57382; DTXCID701475318; Delavirdine (mesylate)

Frequently Asked Questions

What are the CAS number and molecular formula of Delavirdine, Mesylate?

CAS 147221-93-0; molecular formula C23H32N6O6S2; molecular weight — g/mol.

What other names is Delavirdine, Mesylate known by?

DELAVIRDINE MESYLATE, 147221-93-0, Delavirdine mesilate, Rescriptor, U-90152S, delavirdine methanesulfonate.

Is Delavirdine, Mesylate classified as hazardous?

Hazard statements reported: H302, H312, H315, H319, H332.

What are the key physical properties of Delavirdine, Mesylate?

Melting Point: MP: 226-228 °C /Delavirdine/.

Facts on this page are taken from PubChem (US National Library of Medicine) and Wikidata. Grade-specific data — assay, moisture, particle size, packaging, shelf life — is issued per batch on the COA and is not published here.