BIM-0013951.P001
TL;DR: BIM-0013951.P001 (CAS 5930-84-7) is a chemical compound with molecular formula C28H29N3O2S2 and molecular weight 503.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(7-ethyl-4-oxo-3-phenyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]-N-(2-phenylethyl)acetamide
Also Known As: BIM-0013951.P001, 2-[(7-Ethyl-4-oxo-3-phenyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]-N-(2-phenylethyl)acetamide, 2-[(7-ethyl-4-oxo-3-phenyl-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)thio]-N-(2-phenylethyl)acetamide, 2-[(7-Ethyl-4-oxo-3-phenyl-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]-N-(2-phenylethyl)acetamide, 2-[(7-ethyl-4-oxo-3-phenyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]-N-phenethylacetamide
| Molecular Formula | C28H29N3O2S2 |
|---|---|
| Molecular Weight | 503.17 g/mol |
| LogP | 5.4131 |
| Topological Polar Surface Area | 63.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 503.1701 |
| Heavy Atoms | 35 |
| Complexity | 1380.3522 |
Chemical Identifiers
| CAS Number | 5930-84-7 |
|---|---|
| SMILES | CCC1CCC2=C(C1)SC3=C2C(=O)N(C(=N3)SCC(=O)NCCC4=CC=CC=C4)C5=CC=CC=C5 |
Product Overview
BIM-0013951.P001 (CAS 5930-84-7), with molecular formula C28H29N3O2S2 and molecular weight 503.17 g/mol. IUPAC: 2-[(7-ethyl-4-oxo-3-phenyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]-N-(2-phenylethyl)acetamide.
Chemical Property Profile of BIM-0013951.P001
Property Insights of BIM-0013951.P001
The XLogP value of 5.4131 indicates that BIM-0013951.P001 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 BIM-0013951.P001. Following Lipinski's Rule of Five, BIM-0013951.P001 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BIM-0013951.P001?
The CAS number of BIM-0013951.P001 is 5930-84-7.
What is the molecular formula of BIM-0013951.P001?
The molecular formula of BIM-0013951.P001 is C28H29N3O2S2.
What is the molecular weight of BIM-0013951.P001?
The molecular weight of BIM-0013951.P001 is 503.17 g/mol.
Where can I buy BIM-0013951.P001?
You can request a quote for BIM-0013951.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0013951.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0013951.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.