BIM-0031519.P001
TL;DR: BIM-0031519.P001 (CAS 424801-60-5) is a chemical compound with molecular formula C21H25BrN2O2S and molecular weight 448.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(2-bromobenzoyl)amino]-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Also Known As: BIM-0031519.P001, 2-[(2-bromobenzoyl)amino]-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide, 2-{[(2-bromophenyl)carbonyl]amino}-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide, 2-[(2-BROMOBENZOYL)AMINO]-6-(TERT-PENTYL)-4,5,6,7-TETRAHYDRO-1-BENZOTHIOPHENE-3-CARBOXAMIDE, 6-(1,1-dimethylpropyl)-2-[(2-bromophenyl)carbonylamino]-4,5,6,7-tetrahydrobenz o[b]thiophene-3-carboxamide
| Molecular Formula | C21H25BrN2O2S |
|---|---|
| Molecular Weight | 448.08 g/mol |
| LogP | 5.4029 |
| Topological Polar Surface Area | 72.19 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 448.082 |
| Heavy Atoms | 27 |
| Complexity | 888.30194 |
Chemical Identifiers
| CAS Number | 424801-60-5 |
|---|---|
| SMILES | CCC(C)(C)C1CCC2=C(C1)SC(=C2C(=O)N)NC(=O)C3=CC=CC=C3Br |
Product Overview
BIM-0031519.P001 (CAS 424801-60-5), with molecular formula C21H25BrN2O2S and molecular weight 448.08 g/mol. IUPAC: 2-[(2-bromobenzoyl)amino]-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide.
Chemical Property Profile of BIM-0031519.P001
Property Insights of BIM-0031519.P001
The XLogP value of 5.4029 indicates that BIM-0031519.P001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.19 Ų falls within the moderate polarity range, balancing permeability and solubility for BIM-0031519.P001. Following Lipinski's Rule of Five, BIM-0031519.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-0031519.P001?
The CAS number of BIM-0031519.P001 is 424801-60-5.
What is the molecular formula of BIM-0031519.P001?
The molecular formula of BIM-0031519.P001 is C21H25BrN2O2S.
What is the molecular weight of BIM-0031519.P001?
The molecular weight of BIM-0031519.P001 is 448.08 g/mol.
Where can I buy BIM-0031519.P001?
You can request a quote for BIM-0031519.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0031519.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0031519.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.