BAS 02072583
TL;DR: BAS 02072583 (CAS 325693-72-9) is a chemical compound with molecular formula C18H24N4O3S2 and molecular weight 408.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-[4-(2-hydroxyethyl)piperazin-1-yl]-2-oxoethyl]sulfanyl-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-4-one
Also Known As: BAS 02072583, BIM-0044113.P001, AF-399/14201002, 2-{2-[4-(2-hydroxyethyl)piperazinyl]-2-oxoethylthio}-3,5,6,7,8-pentahydrobenzo [b]thiopheno[2,3-d]pyrimidin-4-one, 1-[4-(2-hydroxyethyl)piperazin-1-yl]-2-[(4-hydroxy-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]ethanone
| Molecular Formula | C18H24N4O3S2 |
|---|---|
| Molecular Weight | 408.13 g/mol |
| LogP | 1.092 |
| Topological Polar Surface Area | 89.53 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 408.129 |
| Heavy Atoms | 27 |
| Complexity | 886.5945 |
Chemical Identifiers
| CAS Number | 325693-72-9 |
|---|---|
| SMILES | C1CCC2=C(C1)C3=C(S2)N=C(NC3=O)SCC(=O)N4CCN(CC4)CCO |
Product Overview
BAS 02072583 (CAS 325693-72-9), with molecular formula C18H24N4O3S2 and molecular weight 408.13 g/mol. IUPAC: 2-[2-[4-(2-hydroxyethyl)piperazin-1-yl]-2-oxoethyl]sulfanyl-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-4-one.
Chemical Property Profile of BAS 02072583
Property Insights of BAS 02072583
The XLogP value of 1.092 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 02072583. The TPSA of 89.53 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 02072583. Following Lipinski's Rule of Five, BAS 02072583 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 02072583?
The CAS number of BAS 02072583 is 325693-72-9.
What is the molecular formula of BAS 02072583?
The molecular formula of BAS 02072583 is C18H24N4O3S2.
What is the molecular weight of BAS 02072583?
The molecular weight of BAS 02072583 is 408.13 g/mol.
Where can I buy BAS 02072583?
You can request a quote for BAS 02072583 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02072583?
Yes, KEHONG BIO provides custom synthesis services for BAS 02072583 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.