(Z)-2-(4-Methyl-benzoylamino)-3-(1-methyl-1H-indol-3-yl)-acrylic acid 2-dimethylamino-ethyl ester
TL;DR: (Z)-2-(4-Methyl-benzoylamino)-3-(1-methyl-1H-indol-3-yl)-acrylic acid 2-dimethylamino-ethyl ester (CAS 890097-64-0) is a chemical compound with molecular formula C24H27N3O3 and molecular weight 405.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(dimethylamino)ethyl (Z)-2-[(4-methylbenzoyl)amino]-3-(1-methylindol-3-yl)prop-2-enoate
Also Known As: (Z)-2-(4-Methyl-benzoylamino)-3-(1-methyl-1H-indol-3-yl)-acrylic acid 2-dimethylamino-ethyl ester, (Z)-2-(dimethylamino)ethyl 3-(1-methyl-1H-indol-3-yl)-2-(4-methylbenzamido)acrylate, 2-(dimethylamino)ethyl (Z)-2-[(4-methylbenzoyl)amino]-3-(1-methylindol-3-yl)prop-2-enoate, 2-dimethylaminoethyl (Z)-2-[(4-methylbenzoyl)amino]-3-(1-methylindol-3-yl)prop-2-enoate, 2-dimethylaminoethyl 2-[(4-methylbenzoyl)amino]-3-(1-methylindol-3-yl)prop-2-enoate
| Molecular Formula | C24H27N3O3 |
|---|---|
| Molecular Weight | 405.21 g/mol |
| LogP | 3.36242 |
| Topological Polar Surface Area | 63.57 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 405.20523 |
| Heavy Atoms | 30 |
| Complexity | 1078.7742 |
Chemical Identifiers
| CAS Number | 890097-64-0 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(=O)N/C(=C\C2=CN(C3=CC=CC=C32)C)/C(=O)OCCN(C)C |
Product Overview
(Z)-2-(4-Methyl-benzoylamino)-3-(1-methyl-1H-indol-3-yl)-acrylic acid 2-dimethylamino-ethyl ester (CAS 890097-64-0), with molecular formula C24H27N3O3 and molecular weight 405.21 g/mol. IUPAC: 2-(dimethylamino)ethyl (Z)-2-[(4-methylbenzoyl)amino]-3-(1-methylindol-3-yl)prop-2-enoate.
Chemical Property Profile of (Z)-2-(4-Methyl-benzoylamino)-3-(1-methyl-1H-indol-3-yl)-acrylic acid 2-dimethylamino-ethyl ester
Property Insights of (Z)-2-(4-Methyl-benzoylamino)-3-(1-methyl-1H-indol-3-yl)-acrylic acid 2-dimethylamino-ethyl ester
The XLogP value of 3.36242 indicates that (Z)-2-(4-Methyl-benzoylamino)-3-(1-methyl-1H-indol-3-yl)-acrylic acid 2-dimethylamino-ethyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.57 Ų falls within the moderate polarity range, balancing permeability and solubility for (Z)-2-(4-Methyl-benzoylamino)-3-(1-methyl-1H-indol-3-yl)-acrylic acid 2-dimethylamino-ethyl ester. Following Lipinski's Rule of Five, (Z)-2-(4-Methyl-benzoylamino)-3-(1-methyl-1H-indol-3-yl)-acrylic acid 2-dimethylamino-ethyl ester has 1 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 (Z)-2-(4-Methyl-benzoylamino)-3-(1-methyl-1H-indol-3-yl)-acrylic acid 2-dimethylamino-ethyl ester?
The CAS number of (Z)-2-(4-Methyl-benzoylamino)-3-(1-methyl-1H-indol-3-yl)-acrylic acid 2-dimethylamino-ethyl ester is 890097-64-0.
What is the molecular formula of (Z)-2-(4-Methyl-benzoylamino)-3-(1-methyl-1H-indol-3-yl)-acrylic acid 2-dimethylamino-ethyl ester?
The molecular formula of (Z)-2-(4-Methyl-benzoylamino)-3-(1-methyl-1H-indol-3-yl)-acrylic acid 2-dimethylamino-ethyl ester is C24H27N3O3.
What is the molecular weight of (Z)-2-(4-Methyl-benzoylamino)-3-(1-methyl-1H-indol-3-yl)-acrylic acid 2-dimethylamino-ethyl ester?
The molecular weight of (Z)-2-(4-Methyl-benzoylamino)-3-(1-methyl-1H-indol-3-yl)-acrylic acid 2-dimethylamino-ethyl ester is 405.21 g/mol.
Where can I buy (Z)-2-(4-Methyl-benzoylamino)-3-(1-methyl-1H-indol-3-yl)-acrylic acid 2-dimethylamino-ethyl ester?
You can request a quote for (Z)-2-(4-Methyl-benzoylamino)-3-(1-methyl-1H-indol-3-yl)-acrylic acid 2-dimethylamino-ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Z)-2-(4-Methyl-benzoylamino)-3-(1-methyl-1H-indol-3-yl)-acrylic acid 2-dimethylamino-ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for (Z)-2-(4-Methyl-benzoylamino)-3-(1-methyl-1H-indol-3-yl)-acrylic acid 2-dimethylamino-ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.