ChemDiv2_001657
TL;DR: ChemDiv2_001657 (CAS 1005242-74-9) is a chemical compound with molecular formula C20H23N3O3 and molecular weight 353.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[[1-[(4-methylphenyl)methyl]pyrazol-3-yl]carbamoyl]bicyclo[2.2.1]heptane-2-carboxylic acid
Also Known As: ChemDiv2_001657, 2-[[1-[(4-methylphenyl)methyl]pyrazol-3-yl]carbamoyl]bicyclo[2.2.1]heptane-3-carboxylic acid, 3-({[1-(4-methylbenzyl)-1H-pyrazol-3-yl]amino}carbonyl)bicyclo[2.2.1]heptane-2-carboxylic acid, 3-{[1-(4-methylbenzyl)-1H-pyrazol-3-yl]carbamoyl}bicyclo[2.2.1]heptane-2-carboxylic acid, 3-[[1-(4-methylbenzyl)pyrazol-3-yl]carbamoyl]norbornane-2-carboxylic acid
| Molecular Formula | C20H23N3O3 |
|---|---|
| Molecular Weight | 353.17 g/mol |
| LogP | 2.92522 |
| Topological Polar Surface Area | 84.22 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 353.17395 |
| Heavy Atoms | 26 |
| Complexity | 827.0819 |
Chemical Identifiers
| CAS Number | 1005242-74-9 |
|---|---|
| SMILES | CC1=CC=C(C=C1)CN2C=CC(=N2)NC(=O)C3C4CCC(C4)C3C(=O)O |
Product Overview
ChemDiv2_001657 (CAS 1005242-74-9), with molecular formula C20H23N3O3 and molecular weight 353.17 g/mol. IUPAC: 3-[[1-[(4-methylphenyl)methyl]pyrazol-3-yl]carbamoyl]bicyclo[2.2.1]heptane-2-carboxylic acid.
Chemical Property Profile of ChemDiv2_001657
Property Insights of ChemDiv2_001657
The XLogP value of 2.92522 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ChemDiv2_001657. The TPSA of 84.22 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv2_001657. Following Lipinski's Rule of Five, ChemDiv2_001657 has 2 hydrogen bond donor(s) and 3 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 ChemDiv2_001657?
The CAS number of ChemDiv2_001657 is 1005242-74-9.
What is the molecular formula of ChemDiv2_001657?
The molecular formula of ChemDiv2_001657 is C20H23N3O3.
What is the molecular weight of ChemDiv2_001657?
The molecular weight of ChemDiv2_001657 is 353.17 g/mol.
Where can I buy ChemDiv2_001657?
You can request a quote for ChemDiv2_001657 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv2_001657?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv2_001657 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.