BAS 04913273
TL;DR: BAS 04913273 (CAS 510724-65-9) is a chemical compound with molecular formula C20H18ClN3O2S2 and molecular weight 431.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-chlorophenyl)-2-[(12-oxo-11-prop-2-enyl-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-10-yl)sulfanyl]acetamide
Also Known As: BAS 04913273, N-(4-chlorophenyl)-2-[(12-oxo-11-prop-2-enyl-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-10-yl)sulfanyl]acetamide, 2-((3-allyl-4-oxo-4,5,6,7-tetrahydro-3H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-2-yl)thio)-N-(4-chlorophenyl)acetamide, N-(4-chlorophenyl)-2-(4-oxo-3-prop-2-enyl(3,5,6,7-tetrahydrocyclopenta[2,1-d]p yrimidino[4,5-b]thiophen-2-ylthio))acetamide, N-(4-chlorophenyl)-2-{[4-oxo-3-(prop-2-en-1-yl)-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetamide
| Molecular Formula | C20H18ClN3O2S2 |
|---|---|
| Molecular Weight | 431.05 g/mol |
| LogP | 4.5169 |
| Topological Polar Surface Area | 63.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 431.0529 |
| Heavy Atoms | 28 |
| Complexity | 1119.1666 |
Chemical Identifiers
| CAS Number | 510724-65-9 |
|---|---|
| SMILES | C=CCN1C(=O)C2=C(N=C1SCC(=O)NC3=CC=C(C=C3)Cl)SC4=C2CCC4 |
Product Overview
BAS 04913273 (CAS 510724-65-9), with molecular formula C20H18ClN3O2S2 and molecular weight 431.05 g/mol. IUPAC: N-(4-chlorophenyl)-2-[(12-oxo-11-prop-2-enyl-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-10-yl)sulfanyl]acetamide.
Chemical Property Profile of BAS 04913273
Property Insights of BAS 04913273
The XLogP value of 4.5169 indicates that BAS 04913273 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.99 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 04913273. Following Lipinski's Rule of Five, BAS 04913273 has 1 hydrogen bond donor(s) and 5 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 04913273?
The CAS number of BAS 04913273 is 510724-65-9.
What is the molecular formula of BAS 04913273?
The molecular formula of BAS 04913273 is C20H18ClN3O2S2.
What is the molecular weight of BAS 04913273?
The molecular weight of BAS 04913273 is 431.05 g/mol.
Where can I buy BAS 04913273?
You can request a quote for BAS 04913273 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 04913273?
Yes, KEHONG BIO provides custom synthesis services for BAS 04913273 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.