N-[(3,4-dichloro-2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)acetyl]-L-valine
TL;DR: N-[(3,4-dichloro-2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)acetyl]-L-valine (CAS 308284-54-0) is a chemical compound with molecular formula C11H12Cl2N2O5 and molecular weight 322.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-[[2-(3,4-dichloro-2,5-dioxopyrrol-1-yl)acetyl]amino]-3-methylbutanoic acid
Also Known As: N-[(3,4-dichloro-2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)acetyl]-L-valine, (2S)-2-[[2-(3,4-dichloro-2,5-dioxopyrrol-1-yl)acetyl]amino]-3-methylbutanoic acid, 2-[[2-(3,4-dichloro-2,5-dioxo-pyrrol-1-yl)acetyl]amino]-3-methyl-butanoic Acid, (S)-2-(2-(3,4-dichloro-2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)acetamido)-3-methylbutanoic acid
| Molecular Formula | C11H12Cl2N2O5 |
|---|---|
| Molecular Weight | 322.01 g/mol |
| LogP | 0.2698 |
| Topological Polar Surface Area | 103.78 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 322.01233 |
| Heavy Atoms | 20 |
| Complexity | 490.94287 |
Chemical Identifiers
| CAS Number | 308284-54-0 |
|---|---|
| SMILES | CC(C)[C@@H](C(=O)O)NC(=O)CN1C(=O)C(=C(C1=O)Cl)Cl |
Product Overview
N-[(3,4-dichloro-2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)acetyl]-L-valine (CAS 308284-54-0), with molecular formula C11H12Cl2N2O5 and molecular weight 322.01 g/mol. IUPAC: (2S)-2-[[2-(3,4-dichloro-2,5-dioxopyrrol-1-yl)acetyl]amino]-3-methylbutanoic acid.
Chemical Property Profile of N-[(3,4-dichloro-2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)acetyl]-L-valine
Property Insights of N-[(3,4-dichloro-2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)acetyl]-L-valine
The XLogP value of 0.2698 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[(3,4-dichloro-2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)acetyl]-L-valine. The TPSA of 103.78 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[(3,4-dichloro-2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)acetyl]-L-valine. Following Lipinski's Rule of Five, N-[(3,4-dichloro-2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)acetyl]-L-valine 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 N-[(3,4-dichloro-2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)acetyl]-L-valine?
The CAS number of N-[(3,4-dichloro-2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)acetyl]-L-valine is 308284-54-0.
What is the molecular formula of N-[(3,4-dichloro-2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)acetyl]-L-valine?
The molecular formula of N-[(3,4-dichloro-2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)acetyl]-L-valine is C11H12Cl2N2O5.
What is the molecular weight of N-[(3,4-dichloro-2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)acetyl]-L-valine?
The molecular weight of N-[(3,4-dichloro-2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)acetyl]-L-valine is 322.01 g/mol.
Where can I buy N-[(3,4-dichloro-2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)acetyl]-L-valine?
You can request a quote for N-[(3,4-dichloro-2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)acetyl]-L-valine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(3,4-dichloro-2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)acetyl]-L-valine?
Yes, KEHONG BIO provides custom synthesis services for N-[(3,4-dichloro-2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)acetyl]-L-valine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.