![(2S)-4-methyl-2-[(3-nitropyridin-2-yl)sulfanylamino]pentanoic acid structure](/static/products/7686/76863-77-9.webp)
(2S)-4-methyl-2-[(3-nitropyridin-2-yl)sulfanylamino]pentanoic acid
TL;DR: (2S)-4-methyl-2-[(3-nitropyridin-2-yl)sulfanylamino]pentanoic acid (CAS 76863-77-9) is a chemical compound with molecular formula C11H15N3O4S and molecular weight 285.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-4-methyl-2-[(3-nitro-2-pyridinyl)sulfanylamino]pentanoic acid
Also Known As: N-(3-Nitro-2-pyridinesulfenyl)-L-leucine, HY-W142034, (2S)-4-methyl-2-[(3-nitropyridin-2-yl)sulfanylamino]pentanoic acid, L-Leucine,N-[(3-nitro-2-pyridinyl)thio]-, N-[(3-Nitropyridin-2-yl)sulfanyl]-L-leucine
| Molecular Formula | C11H15N3O4S |
|---|---|
| Molecular Weight | 285.08 g/mol |
| LogP | -0.1 |
| Topological Polar Surface Area | 133.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 285.07834 |
| Heavy Atoms | 19 |
| Complexity | 322.0 |
Chemical Identifiers
| CAS Number | 76863-77-9 |
|---|---|
| SMILES | CC(C)C[C@@H](C(=O)O)NSC1=C(C=CC=N1)[N+](=O)[O-] |
| InChIKey | QCVUBDSGNDCAAO-QMMMGPOBSA-N |
Product Overview
(2S)-4-methyl-2-[(3-nitropyridin-2-yl)sulfanylamino]pentanoic acid (CAS 76863-77-9), with molecular formula C11H15N3O4S and molecular weight 285.08 g/mol. IUPAC: (2S)-4-methyl-2-[(3-nitro-2-pyridinyl)sulfanylamino]pentanoic acid.
Chemical Property Profile of (2S)-4-methyl-2-[(3-nitropyridin-2-yl)sulfanylamino]pentanoic acid
Property Insights of (2S)-4-methyl-2-[(3-nitropyridin-2-yl)sulfanylamino]pentanoic acid
The XLogP value of -0.1 indicates that (2S)-4-methyl-2-[(3-nitropyridin-2-yl)sulfanylamino]pentanoic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 133.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (2S)-4-methyl-2-[(3-nitropyridin-2-yl)sulfanylamino]pentanoic acid. Following Lipinski's Rule of Five, (2S)-4-methyl-2-[(3-nitropyridin-2-yl)sulfanylamino]pentanoic acid has 2 hydrogen bond donor(s) and 7 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 (2S)-4-methyl-2-[(3-nitropyridin-2-yl)sulfanylamino]pentanoic acid?
The CAS number of (2S)-4-methyl-2-[(3-nitropyridin-2-yl)sulfanylamino]pentanoic acid is 76863-77-9.
What is the molecular formula of (2S)-4-methyl-2-[(3-nitropyridin-2-yl)sulfanylamino]pentanoic acid?
The molecular formula of (2S)-4-methyl-2-[(3-nitropyridin-2-yl)sulfanylamino]pentanoic acid is C11H15N3O4S.
What is the molecular weight of (2S)-4-methyl-2-[(3-nitropyridin-2-yl)sulfanylamino]pentanoic acid?
The molecular weight of (2S)-4-methyl-2-[(3-nitropyridin-2-yl)sulfanylamino]pentanoic acid is 285.08 g/mol.
Where can I buy (2S)-4-methyl-2-[(3-nitropyridin-2-yl)sulfanylamino]pentanoic acid?
You can request a quote for (2S)-4-methyl-2-[(3-nitropyridin-2-yl)sulfanylamino]pentanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2S)-4-methyl-2-[(3-nitropyridin-2-yl)sulfanylamino]pentanoic acid?
Yes, KEHONG BIO provides custom synthesis services for (2S)-4-methyl-2-[(3-nitropyridin-2-yl)sulfanylamino]pentanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.