BIM-0046431.P001
TL;DR: BIM-0046431.P001 (CAS 354548-99-5) is a chemical compound with molecular formula C19H22N2O7S and molecular weight 422.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 5-carbamoyl-4-methyl-2-[(3,4,5-trimethoxybenzoyl)amino]thiophene-3-carboxylate
Also Known As: BIM-0046431.P001, ethyl 5-carbamoyl-4-methyl-2-[(3,4,5-trimethoxybenzoyl)amino]thiophene-3-carboxylate, ethyl 5-(aminocarbonyl)-4-methyl-2-[(3,4,5-trimethoxybenzoyl)amino]-3-thiophenecarboxylate, ETHYL 5-CARBAMOYL-4-METHYL-2-(3,4,5-TRIMETHOXYBENZAMIDO)THIOPHENE-3-CARBOXYLATE, ethyl 5-carbamoyl-4-methyl-2-[(3,4,5-trimethoxyphenyl)carbonylamino]thiophene- 3-carboxylate
| Molecular Formula | C19H22N2O7S |
|---|---|
| Molecular Weight | 422.11 g/mol |
| LogP | 2.61022 |
| Topological Polar Surface Area | 126.18 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 422.11478 |
| Heavy Atoms | 29 |
| Complexity | 927.26965 |
Chemical Identifiers
| CAS Number | 354548-99-5 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC(=C1C)C(=O)N)NC(=O)C2=CC(=C(C(=C2)OC)OC)OC |
Product Overview
BIM-0046431.P001 (CAS 354548-99-5), with molecular formula C19H22N2O7S and molecular weight 422.11 g/mol. IUPAC: ethyl 5-carbamoyl-4-methyl-2-[(3,4,5-trimethoxybenzoyl)amino]thiophene-3-carboxylate.
Chemical Property Profile of BIM-0046431.P001
Property Insights of BIM-0046431.P001
The XLogP value of 2.61022 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BIM-0046431.P001. The TPSA of 126.18 Ų falls within the moderate polarity range, balancing permeability and solubility for BIM-0046431.P001. Following Lipinski's Rule of Five, BIM-0046431.P001 has 2 hydrogen bond donor(s) and 8 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-0046431.P001?
The CAS number of BIM-0046431.P001 is 354548-99-5.
What is the molecular formula of BIM-0046431.P001?
The molecular formula of BIM-0046431.P001 is C19H22N2O7S.
What is the molecular weight of BIM-0046431.P001?
The molecular weight of BIM-0046431.P001 is 422.11 g/mol.
Where can I buy BIM-0046431.P001?
You can request a quote for BIM-0046431.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0046431.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0046431.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.