2-Propenoic acid, 2-cyano-3-(2-thiazolylamino)-, ethyl ester, (Z)-
TL;DR: 2-Propenoic acid, 2-cyano-3-(2-thiazolylamino)-, ethyl ester, (Z)- (CAS 51991-99-2) is a chemical compound with molecular formula C9H9N3O2S and molecular weight 223.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl (Z)-2-cyano-3-(1,3-thiazol-2-ylamino)prop-2-enoate
Also Known As: ethyl (2Z)-2-cyano-3-(1,3-thiazol-2-ylamino)prop-2-enoate, ethyl (Z)-2-cyano-3-(1,3-thiazol-2-ylamino)prop-2-enoate, Ethyl (2Z)-2-cyano-3-[(1,3-thiazol-2-yl)amino]prop-2-enoate, 2-Propenoic acid, 2-cyano-3-(2-thiazolylamino)-, ethyl ester, (Z)-
| Molecular Formula | C9H9N3O2S |
|---|---|
| Molecular Weight | 223.04 g/mol |
| LogP | 1.52558 |
| Topological Polar Surface Area | 75.01 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 223.04155 |
| Heavy Atoms | 15 |
| Complexity | 391.99 |
Chemical Identifiers
| CAS Number | 51991-99-2 |
|---|---|
| SMILES | CCOC(=O)/C(=C\NC1=NC=CS1)/C#N |
Product Overview
2-Propenoic acid, 2-cyano-3-(2-thiazolylamino)-, ethyl ester, (Z)- (CAS 51991-99-2), with molecular formula C9H9N3O2S and molecular weight 223.04 g/mol. IUPAC: ethyl (Z)-2-cyano-3-(1,3-thiazol-2-ylamino)prop-2-enoate.
Chemical Property Profile of 2-Propenoic acid, 2-cyano-3-(2-thiazolylamino)-, ethyl ester, (Z)-
Property Insights of 2-Propenoic acid, 2-cyano-3-(2-thiazolylamino)-, ethyl ester, (Z)-
The XLogP value of 1.52558 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Propenoic acid, 2-cyano-3-(2-thiazolylamino)-, ethyl ester, (Z)-. The TPSA of 75.01 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Propenoic acid, 2-cyano-3-(2-thiazolylamino)-, ethyl ester, (Z)-. Following Lipinski's Rule of Five, 2-Propenoic acid, 2-cyano-3-(2-thiazolylamino)-, ethyl ester, (Z)- has 1 hydrogen bond donor(s) and 6 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 2-Propenoic acid, 2-cyano-3-(2-thiazolylamino)-, ethyl ester, (Z)-?
The CAS number of 2-Propenoic acid, 2-cyano-3-(2-thiazolylamino)-, ethyl ester, (Z)- is 51991-99-2.
What is the molecular formula of 2-Propenoic acid, 2-cyano-3-(2-thiazolylamino)-, ethyl ester, (Z)-?
The molecular formula of 2-Propenoic acid, 2-cyano-3-(2-thiazolylamino)-, ethyl ester, (Z)- is C9H9N3O2S.
What is the molecular weight of 2-Propenoic acid, 2-cyano-3-(2-thiazolylamino)-, ethyl ester, (Z)-?
The molecular weight of 2-Propenoic acid, 2-cyano-3-(2-thiazolylamino)-, ethyl ester, (Z)- is 223.04 g/mol.
Where can I buy 2-Propenoic acid, 2-cyano-3-(2-thiazolylamino)-, ethyl ester, (Z)-?
You can request a quote for 2-Propenoic acid, 2-cyano-3-(2-thiazolylamino)-, ethyl ester, (Z)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Propenoic acid, 2-cyano-3-(2-thiazolylamino)-, ethyl ester, (Z)-?
Yes, KEHONG BIO provides custom synthesis services for 2-Propenoic acid, 2-cyano-3-(2-thiazolylamino)-, ethyl ester, (Z)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.