![Diethyl 2-[(2-amino-1,3-thiazole-4-carbonyl)amino]pentanedioate structure](/static/products/4049/40497-74-3.webp)
Diethyl 2-[(2-amino-1,3-thiazole-4-carbonyl)amino]pentanedioate
TL;DR: Diethyl 2-[(2-amino-1,3-thiazole-4-carbonyl)amino]pentanedioate (CAS 40497-74-3) is a chemical compound with molecular formula C13H19N3O5S and molecular weight 329.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl 2-[(2-amino-1,3-thiazole-4-carbonyl)amino]pentanedioate
Also Known As: diethyl n-[(2-amino-1,3-thiazol-4-yl)carbonyl]glutamate, diethyl 2-[(2-amino-1,3-thiazole-4-carbonyl)amino]pentanedioate
| Molecular Formula | C13H19N3O5S |
|---|---|
| Molecular Weight | 329.10 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 149.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 10 |
| Exact Mass | 329.10455 |
| Heavy Atoms | 22 |
| Complexity | 407.0 |
Chemical Identifiers
| CAS Number | 40497-74-3 |
|---|---|
| SMILES | CCOC(=O)CCC(C(=O)OCC)NC(=O)C1=CSC(=N1)N |
| InChIKey | UMEPTYFGMKVNJR-UHFFFAOYSA-N |
Product Overview
Diethyl 2-[(2-amino-1,3-thiazole-4-carbonyl)amino]pentanedioate (CAS 40497-74-3), with molecular formula C13H19N3O5S and molecular weight 329.10 g/mol. IUPAC: diethyl 2-[(2-amino-1,3-thiazole-4-carbonyl)amino]pentanedioate.
Chemical Property Profile of Diethyl 2-[(2-amino-1,3-thiazole-4-carbonyl)amino]pentanedioate
Property Insights of Diethyl 2-[(2-amino-1,3-thiazole-4-carbonyl)amino]pentanedioate
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Diethyl 2-[(2-amino-1,3-thiazole-4-carbonyl)amino]pentanedioate. The TPSA of 149.0 Ų indicates high polarity, suggesting Diethyl 2-[(2-amino-1,3-thiazole-4-carbonyl)amino]pentanedioate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Diethyl 2-[(2-amino-1,3-thiazole-4-carbonyl)amino]pentanedioate has 2 hydrogen bond donor(s) and 8 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 Diethyl 2-[(2-amino-1,3-thiazole-4-carbonyl)amino]pentanedioate?
The CAS number of Diethyl 2-[(2-amino-1,3-thiazole-4-carbonyl)amino]pentanedioate is 40497-74-3.
What is the molecular formula of Diethyl 2-[(2-amino-1,3-thiazole-4-carbonyl)amino]pentanedioate?
The molecular formula of Diethyl 2-[(2-amino-1,3-thiazole-4-carbonyl)amino]pentanedioate is C13H19N3O5S.
What is the molecular weight of Diethyl 2-[(2-amino-1,3-thiazole-4-carbonyl)amino]pentanedioate?
The molecular weight of Diethyl 2-[(2-amino-1,3-thiazole-4-carbonyl)amino]pentanedioate is 329.10 g/mol.
Where can I buy Diethyl 2-[(2-amino-1,3-thiazole-4-carbonyl)amino]pentanedioate?
You can request a quote for Diethyl 2-[(2-amino-1,3-thiazole-4-carbonyl)amino]pentanedioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diethyl 2-[(2-amino-1,3-thiazole-4-carbonyl)amino]pentanedioate?
Yes, KEHONG BIO provides custom synthesis services for Diethyl 2-[(2-amino-1,3-thiazole-4-carbonyl)amino]pentanedioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.