Cambridge id 5914922
TL;DR: Cambridge id 5914922 (CAS 356587-36-5) is a chemical compound with molecular formula C14H14N2O3S2 and molecular weight 322.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
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]acetic acid
Also Known As: BIM-0036928.P001, 2-((3-allyl-4-oxo-4,5,6,7-tetrahydro-3H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-2-yl)thio)acetic acid, 2-(4-oxo-3-prop-2-enyl-3,5,6,7-tetrahydrocyclopenta[2,1-d]pyrimidino[4,5-b]thi ophen-2-ylthio)acetic acid
| Molecular Formula | C14H14N2O3S2 |
|---|---|
| Molecular Weight | 322.04 g/mol |
| LogP | 2.3094 |
| Topological Polar Surface Area | 72.19 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 322.0446 |
| Heavy Atoms | 21 |
| Complexity | 791.5935 |
Chemical Identifiers
| CAS Number | 356587-36-5 |
|---|---|
| SMILES | C=CCN1C(=O)C2=C(N=C1SCC(=O)O)SC3=C2CCC3 |
Product Overview
Cambridge id 5914922 (CAS 356587-36-5), with molecular formula C14H14N2O3S2 and molecular weight 322.04 g/mol. IUPAC: 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]acetic acid.
Chemical Property Profile of Cambridge id 5914922
Property Insights of Cambridge id 5914922
The XLogP value of 2.3094 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Cambridge id 5914922. The TPSA of 72.19 Ų falls within the moderate polarity range, balancing permeability and solubility for Cambridge id 5914922. Following Lipinski's Rule of Five, Cambridge id 5914922 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 Cambridge id 5914922?
The CAS number of Cambridge id 5914922 is 356587-36-5.
What is the molecular formula of Cambridge id 5914922?
The molecular formula of Cambridge id 5914922 is C14H14N2O3S2.
What is the molecular weight of Cambridge id 5914922?
The molecular weight of Cambridge id 5914922 is 322.04 g/mol.
Where can I buy Cambridge id 5914922?
You can request a quote for Cambridge id 5914922 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cambridge id 5914922?
Yes, KEHONG BIO provides custom synthesis services for Cambridge id 5914922 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.