1H-INDOLE-1-CARBOXYLIC ACID,2,3-DIHYDRO-3-METHYL-2
TL;DR: 1H-INDOLE-1-CARBOXYLIC ACID,2,3-DIHYDRO-3-METHYL-2 (CAS 214610-11-4) is a chemical compound with molecular formula C27H26N4O4S and molecular weight 502.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(2-amino-1,3-thiazol-4-yl)-N-[2-[benzyl-[(2-hydroxy-3-methoxyphenyl)methyl]amino]-2-oxoethyl]benzamide
Also Known As: 1H-INDOLE-1-CARBOXYLIC ACID,2,3-DIHYDRO-3-METHYL-2, 4-(2-amino-1,3-thiazol-4-yl)-N-[2-[benzyl-[(2-hydroxy-3-methoxyphenyl)methyl]amino]-2-oxoethyl]benzamide, 4-(2-aminothiazol-4-yl)-N-[2-[benzyl-[(2-hydroxy-3-methoxy-phenyl)methyl]amino]-2-oxo-ethyl]benzamide, Benzamide, 4-(2-amino-4-thiazolyl)-N-[2-[[(2-hydroxy-3-methoxyphenyl)methyl](phenylmethyl)amino]-2-oxoethyl]-
| Molecular Formula | C27H26N4O4S |
|---|---|
| Molecular Weight | 502.17 g/mol |
| LogP | 4.0653 |
| Topological Polar Surface Area | 117.78 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 502.16748 |
| Heavy Atoms | 36 |
| Complexity | 1339.6581 |
Chemical Identifiers
| CAS Number | 214610-11-4 |
|---|---|
| SMILES | COC1=CC=CC(=C1O)CN(CC2=CC=CC=C2)C(=O)CNC(=O)C3=CC=C(C=C3)C4=CSC(=N4)N |
Product Overview
1H-INDOLE-1-CARBOXYLIC ACID,2,3-DIHYDRO-3-METHYL-2 (CAS 214610-11-4), with molecular formula C27H26N4O4S and molecular weight 502.17 g/mol. IUPAC: 4-(2-amino-1,3-thiazol-4-yl)-N-[2-[benzyl-[(2-hydroxy-3-methoxyphenyl)methyl]amino]-2-oxoethyl]benzamide.
Chemical Property Profile of 1H-INDOLE-1-CARBOXYLIC ACID,2,3-DIHYDRO-3-METHYL-2
Property Insights of 1H-INDOLE-1-CARBOXYLIC ACID,2,3-DIHYDRO-3-METHYL-2
The XLogP value of 4.0653 indicates that 1H-INDOLE-1-CARBOXYLIC ACID,2,3-DIHYDRO-3-METHYL-2 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 117.78 Ų falls within the moderate polarity range, balancing permeability and solubility for 1H-INDOLE-1-CARBOXYLIC ACID,2,3-DIHYDRO-3-METHYL-2. Following Lipinski's Rule of Five, 1H-INDOLE-1-CARBOXYLIC ACID,2,3-DIHYDRO-3-METHYL-2 has 3 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1H-INDOLE-1-CARBOXYLIC ACID,2,3-DIHYDRO-3-METHYL-2?
The CAS number of 1H-INDOLE-1-CARBOXYLIC ACID,2,3-DIHYDRO-3-METHYL-2 is 214610-11-4.
What is the molecular formula of 1H-INDOLE-1-CARBOXYLIC ACID,2,3-DIHYDRO-3-METHYL-2?
The molecular formula of 1H-INDOLE-1-CARBOXYLIC ACID,2,3-DIHYDRO-3-METHYL-2 is C27H26N4O4S.
What is the molecular weight of 1H-INDOLE-1-CARBOXYLIC ACID,2,3-DIHYDRO-3-METHYL-2?
The molecular weight of 1H-INDOLE-1-CARBOXYLIC ACID,2,3-DIHYDRO-3-METHYL-2 is 502.17 g/mol.
Where can I buy 1H-INDOLE-1-CARBOXYLIC ACID,2,3-DIHYDRO-3-METHYL-2?
You can request a quote for 1H-INDOLE-1-CARBOXYLIC ACID,2,3-DIHYDRO-3-METHYL-2 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-INDOLE-1-CARBOXYLIC ACID,2,3-DIHYDRO-3-METHYL-2?
Yes, KEHONG BIO provides custom synthesis services for 1H-INDOLE-1-CARBOXYLIC ACID,2,3-DIHYDRO-3-METHYL-2 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.