BIM-0028753.P001
TL;DR: BIM-0028753.P001 (CAS 470472-79-8) is a chemical compound with molecular formula C18H20N2O4S and molecular weight 360.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamoyl]bicyclo[2.2.1]hept-5-ene-2-carboxylic acid
Also Known As: BIM-0028753.P001, 3-[(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamoyl]bicyclo[2.2.1]hept-5-ene-2-carboxylic acid, AB00094045-01, bicyclo[2.2.1]hept-5-ene-2-carboxylic acid, 3-[[[3-(aminocarbonyl)-4,5,6,7-tetrahydrobenzo[b]thien-2-yl]amino]carbonyl]-, 2-[(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamoyl]bicyclo[2.2.1]hept-5-ene-3-carboxylic acid
| Molecular Formula | C18H20N2O4S |
|---|---|
| Molecular Weight | 360.11 g/mol |
| LogP | 2.1872 |
| Topological Polar Surface Area | 109.49 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 360.11438 |
| Heavy Atoms | 25 |
| Complexity | 797.2419 |
Chemical Identifiers
| CAS Number | 470472-79-8 |
|---|---|
| SMILES | C1CCC2=C(C1)C(=C(S2)NC(=O)C3C4CC(C3C(=O)O)C=C4)C(=O)N |
Product Overview
BIM-0028753.P001 (CAS 470472-79-8), with molecular formula C18H20N2O4S and molecular weight 360.11 g/mol. IUPAC: 3-[(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamoyl]bicyclo[2.2.1]hept-5-ene-2-carboxylic acid.
Chemical Property Profile of BIM-0028753.P001
Property Insights of BIM-0028753.P001
The XLogP value of 2.1872 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BIM-0028753.P001. The TPSA of 109.49 Ų falls within the moderate polarity range, balancing permeability and solubility for BIM-0028753.P001. Following Lipinski's Rule of Five, BIM-0028753.P001 has 3 hydrogen bond donor(s) and 4 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-0028753.P001?
The CAS number of BIM-0028753.P001 is 470472-79-8.
What is the molecular formula of BIM-0028753.P001?
The molecular formula of BIM-0028753.P001 is C18H20N2O4S.
What is the molecular weight of BIM-0028753.P001?
The molecular weight of BIM-0028753.P001 is 360.11 g/mol.
Where can I buy BIM-0028753.P001?
You can request a quote for BIM-0028753.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0028753.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0028753.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.