BIM-0042679.P001
TL;DR: BIM-0042679.P001 (CAS 329067-41-6) is a chemical compound with molecular formula C23H21BrN2O2S and molecular weight 468.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(3-bromobenzoyl)amino]-N-(2-methylphenyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Also Known As: BIM-0042679.P001, 2-[(3-bromobenzoyl)amino]-N-(2-methylphenyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide, {2-[(3-bromophenyl)carbonylamino](4,5,6,7-tetrahydrobenzo[b]thiophen-3-yl)}-N- (2-methylphenyl)carboxamide, 2-(3-BROMOBENZAMIDO)-N-(2-METHYLPHENYL)-4,5,6,7-TETRAHYDRO-1-BENZOTHIOPHENE-3-CARBOXAMIDE, 2-{[(3-bromophenyl)carbonyl]amino}-N-(2-methylphenyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
| Molecular Formula | C23H21BrN2O2S |
|---|---|
| Molecular Weight | 468.05 g/mol |
| LogP | 6.20242 |
| Topological Polar Surface Area | 58.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 468.05072 |
| Heavy Atoms | 29 |
| Complexity | 1090.2319 |
Chemical Identifiers
| CAS Number | 329067-41-6 |
|---|---|
| SMILES | CC1=CC=CC=C1NC(=O)C2=C(SC3=C2CCCC3)NC(=O)C4=CC(=CC=C4)Br |
Product Overview
BIM-0042679.P001 (CAS 329067-41-6), with molecular formula C23H21BrN2O2S and molecular weight 468.05 g/mol. IUPAC: 2-[(3-bromobenzoyl)amino]-N-(2-methylphenyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide.
Chemical Property Profile of BIM-0042679.P001
Property Insights of BIM-0042679.P001
The XLogP value of 6.20242 indicates that BIM-0042679.P001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.2 Ų, BIM-0042679.P001 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BIM-0042679.P001 has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BIM-0042679.P001?
The CAS number of BIM-0042679.P001 is 329067-41-6.
What is the molecular formula of BIM-0042679.P001?
The molecular formula of BIM-0042679.P001 is C23H21BrN2O2S.
What is the molecular weight of BIM-0042679.P001?
The molecular weight of BIM-0042679.P001 is 468.05 g/mol.
Where can I buy BIM-0042679.P001?
You can request a quote for BIM-0042679.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0042679.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0042679.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.