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Details

Stereochemistry ACHIRAL
Molecular Formula C17H19FN4O5S
Molecular Weight 410.42
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BMS-707035

SMILES

CN1C(=O)C(O)=C(N=C1N2CCCCS2(=O)=O)C(=O)NCC3=CC=C(F)C=C3

InChI

InChIKey=VNIWZCGZPBJWBI-UHFFFAOYSA-N
InChI=1S/C17H19FN4O5S/c1-21-16(25)14(23)13(15(24)19-10-11-4-6-12(18)7-5-11)20-17(21)22-8-2-3-9-28(22,26)27/h4-7,23H,2-3,8-10H2,1H3,(H,19,24)

HIDE SMILES / InChI

Molecular Formula C17H19FN4O5S
Molecular Weight 410.42
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Description
Curator's Comment: Description was created based on several sources, including http://www.selleckchem.com/products/BMS-707035.html

BMS-707035 is a potent, specific, and reversible HIV-I integrase (IN) inhibitor that blocks HIV IN strand transfer activity. Bristol-Myers Squibb was developing BMS-707035 for the treatment of HIV infections, however development was discontinued.

Originator

Curator's Comment: # Bristol-Myers Squibb

Approval Year

TargetsConditions

Conditions

ConditionModalityTargetsHighest PhaseProduct
Primary
Unknown

Approved Use

Unknown
Sourcing

Sourcing

PubMed

PubMed

TitleDatePubMed
HIV-1 integrase inhibitors: an emerging clinical reality.
2007
Anti-infectives: clinical progress of HIV-1 integrase inhibitors.
2008 Jun
3-Hydroxy-6,7-dihydropyrimido[2,1-c][1,4]oxazin-4(9H)-ones as new HIV-1 integrase inhibitors WO2011046873 A1.
2011 Nov
Patents

Sample Use Guides

In Vivo Use Guide
Unknown
Route of Administration: Unknown
In Vitro Use Guide
Unknown
Substance Class Chemical
Created
by admin
on Sat Dec 16 11:11:44 GMT 2023
Edited
by admin
on Sat Dec 16 11:11:44 GMT 2023
Record UNII
7PR4P7YOKT
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BMS-707035
Common Name English
BMS 707035
Common Name English
Code System Code Type Description
EPA CompTox
DTXSID601025869
Created by admin on Sat Dec 16 11:11:44 GMT 2023 , Edited by admin on Sat Dec 16 11:11:44 GMT 2023
PRIMARY
PUBCHEM
54682040
Created by admin on Sat Dec 16 11:11:44 GMT 2023 , Edited by admin on Sat Dec 16 11:11:44 GMT 2023
PRIMARY
FDA UNII
7PR4P7YOKT
Created by admin on Sat Dec 16 11:11:44 GMT 2023 , Edited by admin on Sat Dec 16 11:11:44 GMT 2023
PRIMARY
CAS
729607-74-3
Created by admin on Sat Dec 16 11:11:44 GMT 2023 , Edited by admin on Sat Dec 16 11:11:44 GMT 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY