Ureidovaline
TL;DR: Ureidovaline (CAS 101527-01-9) is a chemical compound with molecular formula C14H23N3O3S and molecular weight 313.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-3-methyl-2-[[methyl-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]carbamoyl]amino]butanoic acid
Also Known As: Ureidovaline, mtv-iii, N-[2-Isopropylthiazol-4-ylmethyl(methyl)carbamoyl]-L-valine, Ritonavir EP Impurity A, Ritonavir impurity A
| Molecular Formula | C14H23N3O3S |
|---|---|
| Molecular Weight | 313.15 g/mol |
| LogP | 2.5171 |
| Topological Polar Surface Area | 82.53 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 313.14603 |
| Heavy Atoms | 21 |
| Complexity | 499.4086 |
Chemical Identifiers
| CAS Number | 101527-01-9 |
|---|---|
| SMILES | CC(C)C1=NC(=CS1)CN(C)C(=O)N[C@@H](C(C)C)C(=O)O |
Product Overview
Ureidovaline (CAS 101527-01-9), with molecular formula C14H23N3O3S and molecular weight 313.15 g/mol. IUPAC: (2S)-3-methyl-2-[[methyl-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]carbamoyl]amino]butanoic acid.
Chemical Property Profile of Ureidovaline
Property Insights of Ureidovaline
The XLogP value of 2.5171 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ureidovaline. The TPSA of 82.53 Ų falls within the moderate polarity range, balancing permeability and solubility for Ureidovaline. Following Lipinski's Rule of Five, Ureidovaline has 2 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 Ureidovaline?
The CAS number of Ureidovaline is 101527-01-9.
What is the molecular formula of Ureidovaline?
The molecular formula of Ureidovaline is C14H23N3O3S.
What is the molecular weight of Ureidovaline?
The molecular weight of Ureidovaline is 313.15 g/mol.
Where can I buy Ureidovaline?
You can request a quote for Ureidovaline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ureidovaline?
Yes, KEHONG BIO provides custom synthesis services for Ureidovaline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.