BIM-0015194.P001
TL;DR: BIM-0015194.P001 (CAS 330555-62-9) is a chemical compound with molecular formula C21H27N3O3S2 and molecular weight 433.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[2-(4,6-dimethylpyrimidin-2-yl)sulfanylbutanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Also Known As: BIM-0015194.P001, A1890/0079375, ethyl 2-({2-[(4,6-dimethylpyrimidin-2-yl)sulfanyl]butanoyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate, ethyl 2-(2-((4,6-dimethylpyrimidin-2-yl)thio)butanamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate, ethyl 2-[2-(4,6-dimethylpyrimidin-2-yl)sulfanylbutanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
| Molecular Formula | C21H27N3O3S2 |
|---|---|
| Molecular Weight | 433.15 g/mol |
| LogP | 4.71984 |
| Topological Polar Surface Area | 81.18 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 433.14938 |
| Heavy Atoms | 29 |
| Complexity | 890.5665 |
Chemical Identifiers
| CAS Number | 330555-62-9 |
|---|---|
| SMILES | CCC(C(=O)NC1=C(C2=C(S1)CCCC2)C(=O)OCC)SC3=NC(=CC(=N3)C)C |
Product Overview
BIM-0015194.P001 (CAS 330555-62-9), with molecular formula C21H27N3O3S2 and molecular weight 433.15 g/mol. IUPAC: ethyl 2-[2-(4,6-dimethylpyrimidin-2-yl)sulfanylbutanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate.
Chemical Property Profile of BIM-0015194.P001
Property Insights of BIM-0015194.P001
The XLogP value of 4.71984 indicates that BIM-0015194.P001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.18 Ų falls within the moderate polarity range, balancing permeability and solubility for BIM-0015194.P001. Following Lipinski's Rule of Five, BIM-0015194.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-0015194.P001?
The CAS number of BIM-0015194.P001 is 330555-62-9.
What is the molecular formula of BIM-0015194.P001?
The molecular formula of BIM-0015194.P001 is C21H27N3O3S2.
What is the molecular weight of BIM-0015194.P001?
The molecular weight of BIM-0015194.P001 is 433.15 g/mol.
Where can I buy BIM-0015194.P001?
You can request a quote for BIM-0015194.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0015194.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0015194.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.