1H-Indazole-3-carboxylic acid, 1-(p-chlorobenzyl)-, 1,3-dihydroxy-2-propyl ester
TL;DR: 1H-Indazole-3-carboxylic acid, 1-(p-chlorobenzyl)-, 1,3-dihydroxy-2-propyl ester (CAS 50264-96-5) is a chemical compound with molecular formula C18H17ClN2O4 and molecular weight 360.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-dihydroxypropan-2-yl 1-[(4-chlorophenyl)methyl]indazole-3-carboxylate
Also Known As: beta-Glyceryl 1-p-chlorobenzyl-1H-indazole-3-carboxylate, 1H-Indazole-3-carboxylic acid, 1-(p-chlorobenzyl)-, 1,3-dihydroxy-2-propyl ester, 1-(p-Chlorobenzyl)-1H-indazole-3-carboxylic acid 1,3-dihydroxy-2-propyl ester, 1,3-dihydroxypropan-2-yl 1-[(4-chlorophenyl)methyl]indazole-3-carboxylate, 1,3-Dihydroxypropan-2-yl 1-[(4-chlorophenyl)methyl]-1H-indazole-3-carboxylate
| Molecular Formula | C18H17ClN2O4 |
|---|---|
| Molecular Weight | 360.09 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 84.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 360.08768 |
| Heavy Atoms | 25 |
| Complexity | 441.0 |
Chemical Identifiers
| CAS Number | 50264-96-5 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=NN2CC3=CC=C(C=C3)Cl)C(=O)OC(CO)CO |
| InChIKey | VVEDYILSIFBXAG-UHFFFAOYSA-N |
Product Overview
1H-Indazole-3-carboxylic acid, 1-(p-chlorobenzyl)-, 1,3-dihydroxy-2-propyl ester (CAS 50264-96-5), with molecular formula C18H17ClN2O4 and molecular weight 360.09 g/mol. IUPAC: 1,3-dihydroxypropan-2-yl 1-[(4-chlorophenyl)methyl]indazole-3-carboxylate.
Chemical Property Profile of 1H-Indazole-3-carboxylic acid, 1-(p-chlorobenzyl)-, 1,3-dihydroxy-2-propyl ester
Property Insights of 1H-Indazole-3-carboxylic acid, 1-(p-chlorobenzyl)-, 1,3-dihydroxy-2-propyl ester
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-Indazole-3-carboxylic acid, 1-(p-chlorobenzyl)-, 1,3-dihydroxy-2-propyl ester. The TPSA of 84.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 1H-Indazole-3-carboxylic acid, 1-(p-chlorobenzyl)-, 1,3-dihydroxy-2-propyl ester. Following Lipinski's Rule of Five, 1H-Indazole-3-carboxylic acid, 1-(p-chlorobenzyl)-, 1,3-dihydroxy-2-propyl ester has 2 hydrogen bond donor(s) and 5 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 1H-Indazole-3-carboxylic acid, 1-(p-chlorobenzyl)-, 1,3-dihydroxy-2-propyl ester?
The CAS number of 1H-Indazole-3-carboxylic acid, 1-(p-chlorobenzyl)-, 1,3-dihydroxy-2-propyl ester is 50264-96-5.
What is the molecular formula of 1H-Indazole-3-carboxylic acid, 1-(p-chlorobenzyl)-, 1,3-dihydroxy-2-propyl ester?
The molecular formula of 1H-Indazole-3-carboxylic acid, 1-(p-chlorobenzyl)-, 1,3-dihydroxy-2-propyl ester is C18H17ClN2O4.
What is the molecular weight of 1H-Indazole-3-carboxylic acid, 1-(p-chlorobenzyl)-, 1,3-dihydroxy-2-propyl ester?
The molecular weight of 1H-Indazole-3-carboxylic acid, 1-(p-chlorobenzyl)-, 1,3-dihydroxy-2-propyl ester is 360.09 g/mol.
Where can I buy 1H-Indazole-3-carboxylic acid, 1-(p-chlorobenzyl)-, 1,3-dihydroxy-2-propyl ester?
You can request a quote for 1H-Indazole-3-carboxylic acid, 1-(p-chlorobenzyl)-, 1,3-dihydroxy-2-propyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Indazole-3-carboxylic acid, 1-(p-chlorobenzyl)-, 1,3-dihydroxy-2-propyl ester?
Yes, KEHONG BIO provides custom synthesis services for 1H-Indazole-3-carboxylic acid, 1-(p-chlorobenzyl)-, 1,3-dihydroxy-2-propyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.