BIM-0044172.P001
TL;DR: BIM-0044172.P001 (CAS 315239-10-2) is a chemical compound with molecular formula C12H12N2OS2 and molecular weight 264.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
10-prop-2-enylsulfanyl-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-12-one
Also Known As: BIM-0044172.P001, 2-(allylsulfanyl)-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one, AF-399/14202018, F0741-0002, 2-(allylthio)-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one
| Molecular Formula | C12H12N2OS2 |
|---|---|
| Molecular Weight | 264.04 g/mol |
| LogP | 2.7514 |
| Topological Polar Surface Area | 45.75 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 264.0391 |
| Heavy Atoms | 17 |
| Complexity | 641.72845 |
Chemical Identifiers
| CAS Number | 315239-10-2 |
|---|---|
| SMILES | C=CCSC1=NC2=C(C3=C(S2)CCC3)C(=O)N1 |
Product Overview
BIM-0044172.P001 (CAS 315239-10-2), with molecular formula C12H12N2OS2 and molecular weight 264.04 g/mol. IUPAC: 10-prop-2-enylsulfanyl-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-12-one.
Chemical Property Profile of BIM-0044172.P001
Property Insights of BIM-0044172.P001
The XLogP value of 2.7514 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BIM-0044172.P001. With a topological polar surface area (TPSA) of 45.75 Ų, BIM-0044172.P001 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BIM-0044172.P001 has 1 hydrogen bond donor(s) and 4 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 BIM-0044172.P001?
The CAS number of BIM-0044172.P001 is 315239-10-2.
What is the molecular formula of BIM-0044172.P001?
The molecular formula of BIM-0044172.P001 is C12H12N2OS2.
What is the molecular weight of BIM-0044172.P001?
The molecular weight of BIM-0044172.P001 is 264.04 g/mol.
Where can I buy BIM-0044172.P001?
You can request a quote for BIM-0044172.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0044172.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0044172.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.