BIM-0021123.P001
TL;DR: BIM-0021123.P001 (CAS 470472-55-0) is a chemical compound with molecular formula C16H17NO5 and molecular weight 303.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(2-methoxy-5-methylphenyl)carbamoyl]-7-oxabicyclo[2.2.1]hept-5-ene-2-carboxylic acid
Also Known As: BIM-0021123.P001, 3-[(2-methoxy-5-methylanilino)carbonyl]-7-oxabicyclo[2.2.1]hept-5-ene-2-carboxylic acid, 3-[(2-methoxy-5-methylphenyl)carbamoyl]-7-oxabicyclo[2.2.1]hept-5-ene-2-carboxylic acid, 2-[(2-methoxy-5-methylphenyl)carbamoyl]-7-oxabicyclo[2.2.1]hept-5-ene-3-carboxylic acid, 3-((2-methoxy-5-methylphenyl)carbamoyl)-7-oxabicyclo[2.2.1]hept-5-ene-2-carboxylic acid
| Molecular Formula | C16H17NO5 |
|---|---|
| Molecular Weight | 303.11 g/mol |
| LogP | 1.59632 |
| Topological Polar Surface Area | 84.86 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 303.1107 |
| Heavy Atoms | 22 |
| Complexity | 653.9363 |
Chemical Identifiers
| CAS Number | 470472-55-0 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)OC)NC(=O)C2C3C=CC(C2C(=O)O)O3 |
Product Overview
BIM-0021123.P001 (CAS 470472-55-0), with molecular formula C16H17NO5 and molecular weight 303.11 g/mol. IUPAC: 3-[(2-methoxy-5-methylphenyl)carbamoyl]-7-oxabicyclo[2.2.1]hept-5-ene-2-carboxylic acid.
Chemical Property Profile of BIM-0021123.P001
Property Insights of BIM-0021123.P001
The XLogP value of 1.59632 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BIM-0021123.P001. The TPSA of 84.86 Ų falls within the moderate polarity range, balancing permeability and solubility for BIM-0021123.P001. Following Lipinski's Rule of Five, BIM-0021123.P001 has 2 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-0021123.P001?
The CAS number of BIM-0021123.P001 is 470472-55-0.
What is the molecular formula of BIM-0021123.P001?
The molecular formula of BIM-0021123.P001 is C16H17NO5.
What is the molecular weight of BIM-0021123.P001?
The molecular weight of BIM-0021123.P001 is 303.11 g/mol.
Where can I buy BIM-0021123.P001?
You can request a quote for BIM-0021123.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0021123.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0021123.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.