(S)-2-(4-(2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)butanamido)-4-methylpentanoic acid
TL;DR: (S)-2-(4-(2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)butanamido)-4-methylpentanoic acid (CAS 956958-47-7) is a chemical compound with molecular formula C18H23N3O5 and molecular weight 361.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-[4-(2,4-dioxo-1H-quinazolin-3-yl)butanoylamino]-4-methylpentanoic acid
Also Known As: (S)-2-(4-(2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)butanamido)-4-methylpentanoic acid, N-[4-(2-hydroxy-4-oxoquinazolin-3(4H)-yl)butanoyl]-L-leucine, 2-[4-(2,4-dioxo-1H-quinazolin-3-yl)butanoylamino]-4-methyl-pentanoic Acid, N-[4-(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)butanoyl]-L-leucine, (2S)-2-[4-(2,4-dioxo-1H-quinazolin-3-yl)butanoylamino]-4-methylpentanoic acid
| Molecular Formula | C18H23N3O5 |
|---|---|
| Molecular Weight | 361.16 g/mol |
| LogP | 1.0855 |
| Topological Polar Surface Area | 121.26 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 361.16376 |
| Heavy Atoms | 26 |
| Complexity | 912.9179 |
Chemical Identifiers
| CAS Number | 956958-47-7 |
|---|---|
| SMILES | CC(C)C[C@@H](C(=O)O)NC(=O)CCCN1C(=O)C2=CC=CC=C2NC1=O |
Product Overview
(S)-2-(4-(2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)butanamido)-4-methylpentanoic acid (CAS 956958-47-7), with molecular formula C18H23N3O5 and molecular weight 361.16 g/mol. IUPAC: (2S)-2-[4-(2,4-dioxo-1H-quinazolin-3-yl)butanoylamino]-4-methylpentanoic acid.
Chemical Property Profile of (S)-2-(4-(2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)butanamido)-4-methylpentanoic acid
Property Insights of (S)-2-(4-(2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)butanamido)-4-methylpentanoic acid
The XLogP value of 1.0855 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (S)-2-(4-(2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)butanamido)-4-methylpentanoic acid. The TPSA of 121.26 Ų falls within the moderate polarity range, balancing permeability and solubility for (S)-2-(4-(2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)butanamido)-4-methylpentanoic acid. Following Lipinski's Rule of Five, (S)-2-(4-(2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)butanamido)-4-methylpentanoic acid has 3 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 (S)-2-(4-(2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)butanamido)-4-methylpentanoic acid?
The CAS number of (S)-2-(4-(2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)butanamido)-4-methylpentanoic acid is 956958-47-7.
What is the molecular formula of (S)-2-(4-(2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)butanamido)-4-methylpentanoic acid?
The molecular formula of (S)-2-(4-(2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)butanamido)-4-methylpentanoic acid is C18H23N3O5.
What is the molecular weight of (S)-2-(4-(2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)butanamido)-4-methylpentanoic acid?
The molecular weight of (S)-2-(4-(2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)butanamido)-4-methylpentanoic acid is 361.16 g/mol.
Where can I buy (S)-2-(4-(2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)butanamido)-4-methylpentanoic acid?
You can request a quote for (S)-2-(4-(2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)butanamido)-4-methylpentanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (S)-2-(4-(2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)butanamido)-4-methylpentanoic acid?
Yes, KEHONG BIO provides custom synthesis services for (S)-2-(4-(2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)butanamido)-4-methylpentanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.