BAS 03154956
TL;DR: BAS 03154956 (CAS 370574-46-2) is a chemical compound with molecular formula C22H21FN6O4S and molecular weight 484.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-ethyl-2-[4-[(4-fluorobenzoyl)carbamothioyl]piperazin-1-yl]-5-oxopyrido[2,3-d]pyrimidine-6-carboxylic acid
Also Known As: BAS 03154956, 8-ethyl-2-(4-((4-fluorobenzoyl)carbamothioyl)piperazin-1-yl)-5-oxo-5,8-dihydropyrido[2,3-d]pyrimidine-6-carboxylic acid, 8-ethyl-2-(4-{[(4-fluorophenyl)carbonyl]carbamothioyl}piperazin-1-yl)-5-oxo-5,8-dihydropyrido[2,3-d]pyrimidine-6-carboxylic acid, 8-ETHYL-2-(4-{[(4-FLUOROPHENYL)FORMAMIDO]METHANETHIOYL}PIPERAZIN-1-YL)-5-OXO-5H,8H-PYRIDO[2,3-D]PYRIMIDINE-6-CARBOXYLIC ACID, 8-ethyl-2-[4-[(4-fluorobenzoyl)carbamothioyl]piperazin-1-yl]-5-oxopyrido[2,3-d]pyrimidine-6-carboxylic acid
| Molecular Formula | C22H21FN6O4S |
|---|---|
| Molecular Weight | 484.13 g/mol |
| LogP | 1.4856 |
| Topological Polar Surface Area | 120.66 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 484.1329 |
| Heavy Atoms | 34 |
| Complexity | 1335.7145 |
Chemical Identifiers
| CAS Number | 370574-46-2 |
|---|---|
| SMILES | CCN1C=C(C(=O)C2=CN=C(N=C21)N3CCN(CC3)C(=S)NC(=O)C4=CC=C(C=C4)F)C(=O)O |
Product Overview
BAS 03154956 (CAS 370574-46-2), with molecular formula C22H21FN6O4S and molecular weight 484.13 g/mol. IUPAC: 8-ethyl-2-[4-[(4-fluorobenzoyl)carbamothioyl]piperazin-1-yl]-5-oxopyrido[2,3-d]pyrimidine-6-carboxylic acid.
Chemical Property Profile of BAS 03154956
Property Insights of BAS 03154956
The XLogP value of 1.4856 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 03154956. The TPSA of 120.66 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 03154956. Following Lipinski's Rule of Five, BAS 03154956 has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 03154956?
The CAS number of BAS 03154956 is 370574-46-2.
What is the molecular formula of BAS 03154956?
The molecular formula of BAS 03154956 is C22H21FN6O4S.
What is the molecular weight of BAS 03154956?
The molecular weight of BAS 03154956 is 484.13 g/mol.
Where can I buy BAS 03154956?
You can request a quote for BAS 03154956 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 03154956?
Yes, KEHONG BIO provides custom synthesis services for BAS 03154956 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.