BIM-0041613.P001
TL;DR: BIM-0041613.P001 (CAS 372971-51-2) is a chemical compound with molecular formula C15H19N3O2S2 and molecular weight 337.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[(3-amino-8-thia-4,6-diazatricyclo[7.5.0.02,7]tetradeca-1(9),2,4,6-tetraen-5-yl)sulfanyl]acetate
Also Known As: BIM-0041613.P001, AB00102110-01, ethyl 2-((4-amino-6,7,8,9-tetrahydro-5H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-2-yl)thio)acetate, ethyl [(4-amino-6,7,8,9-tetrahydro-5H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetate
| Molecular Formula | C15H19N3O2S2 |
|---|---|
| Molecular Weight | 337.09 g/mol |
| LogP | 3.1976 |
| Topological Polar Surface Area | 78.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 337.09186 |
| Heavy Atoms | 22 |
| Complexity | 699.64264 |
Chemical Identifiers
| CAS Number | 372971-51-2 |
|---|---|
| SMILES | CCOC(=O)CSC1=NC(=C2C3=C(CCCCC3)SC2=N1)N |
Product Overview
BIM-0041613.P001 (CAS 372971-51-2), with molecular formula C15H19N3O2S2 and molecular weight 337.09 g/mol. IUPAC: ethyl 2-[(3-amino-8-thia-4,6-diazatricyclo[7.5.0.02,7]tetradeca-1(9),2,4,6-tetraen-5-yl)sulfanyl]acetate.
Chemical Property Profile of BIM-0041613.P001
Property Insights of BIM-0041613.P001
The XLogP value of 3.1976 indicates that BIM-0041613.P001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.1 Ų falls within the moderate polarity range, balancing permeability and solubility for BIM-0041613.P001. Following Lipinski's Rule of Five, BIM-0041613.P001 has 1 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 BIM-0041613.P001?
The CAS number of BIM-0041613.P001 is 372971-51-2.
What is the molecular formula of BIM-0041613.P001?
The molecular formula of BIM-0041613.P001 is C15H19N3O2S2.
What is the molecular weight of BIM-0041613.P001?
The molecular weight of BIM-0041613.P001 is 337.09 g/mol.
Where can I buy BIM-0041613.P001?
You can request a quote for BIM-0041613.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0041613.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0041613.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.