BIM-0030485.P001
TL;DR: BIM-0030485.P001 (CAS 314244-93-4) is a chemical compound with molecular formula C18H19NO3S2 and molecular weight 361.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[[(E)-3-thiophen-2-ylprop-2-enoyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Also Known As: BIM-0030485.P001, AE-848/10139022, ethyl 2-[[(E)-3-thiophen-2-ylprop-2-enoyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate, ethyl 2-{[3-(2-thienyl)acryloyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate, (E)-ethyl 2-(3-(thiophen-2-yl)acrylamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate
| Molecular Formula | C18H19NO3S2 |
|---|---|
| Molecular Weight | 361.08 g/mol |
| LogP | 4.517 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 361.08063 |
| Heavy Atoms | 24 |
| Complexity | 759.5759 |
Chemical Identifiers
| CAS Number | 314244-93-4 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)/C=C/C3=CC=CS3 |
Product Overview
BIM-0030485.P001 (CAS 314244-93-4), with molecular formula C18H19NO3S2 and molecular weight 361.08 g/mol. IUPAC: ethyl 2-[[(E)-3-thiophen-2-ylprop-2-enoyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate.
Chemical Property Profile of BIM-0030485.P001
Property Insights of BIM-0030485.P001
The XLogP value of 4.517 indicates that BIM-0030485.P001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.4 Ų, BIM-0030485.P001 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BIM-0030485.P001 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 BIM-0030485.P001?
The CAS number of BIM-0030485.P001 is 314244-93-4.
What is the molecular formula of BIM-0030485.P001?
The molecular formula of BIM-0030485.P001 is C18H19NO3S2.
What is the molecular weight of BIM-0030485.P001?
The molecular weight of BIM-0030485.P001 is 361.08 g/mol.
Where can I buy BIM-0030485.P001?
You can request a quote for BIM-0030485.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0030485.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0030485.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.