H-Lysyl-2-(2-nitrophenylsulfenyl)tryptophan methyl ester
TL;DR: H-Lysyl-2-(2-nitrophenylsulfenyl)tryptophan methyl ester (CAS 109064-70-2) is a chemical compound with molecular formula C24H29N5O5S and molecular weight 499.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (2S)-2-[[(2S)-2,6-diaminohexanoyl]amino]-3-[1-(2-nitrophenyl)sulfanylindol-3-yl]propanoate
Also Known As: H-Lys-trp(nps)-ome, H-Lysyl-2-(2-nitrophenylsulfenyl)tryptophan methyl ester, N-L-Lysyl-1-((2-nitrophenyl)thio)-L-tryptophan methyl ester, methyl (2S)-2-[[(2S)-2,6-diaminohexanoyl]amino]-3-[1-(2-nitrophenyl)sulfanylindol-3-yl]propanoate, Methyl L-lysyl-1-[(2-nitrophenyl)sulfanyl]-L-tryptophanate
| Molecular Formula | C24H29N5O5S |
|---|---|
| Molecular Weight | 499.19 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 183.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 12 |
| Exact Mass | 499.18893 |
| Heavy Atoms | 35 |
| Complexity | 723.0 |
Chemical Identifiers
| CAS Number | 109064-70-2 |
|---|---|
| SMILES | COC(=O)[C@H](CC1=CN(C2=CC=CC=C21)SC3=CC=CC=C3[N+](=O)[O-])NC(=O)[C@H](CCCCN)N |
| InChIKey | QGTJIZCTYUGOEQ-OALUTQOASA-N |
Product Overview
H-Lysyl-2-(2-nitrophenylsulfenyl)tryptophan methyl ester (CAS 109064-70-2), with molecular formula C24H29N5O5S and molecular weight 499.19 g/mol. IUPAC: methyl (2S)-2-[[(2S)-2,6-diaminohexanoyl]amino]-3-[1-(2-nitrophenyl)sulfanylindol-3-yl]propanoate.
Chemical Property Profile of H-Lysyl-2-(2-nitrophenylsulfenyl)tryptophan methyl ester
Property Insights of H-Lysyl-2-(2-nitrophenylsulfenyl)tryptophan methyl ester
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for H-Lysyl-2-(2-nitrophenylsulfenyl)tryptophan methyl ester. The TPSA of 183.0 Ų indicates high polarity, suggesting H-Lysyl-2-(2-nitrophenylsulfenyl)tryptophan methyl ester may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, H-Lysyl-2-(2-nitrophenylsulfenyl)tryptophan methyl ester has 3 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 H-Lysyl-2-(2-nitrophenylsulfenyl)tryptophan methyl ester?
The CAS number of H-Lysyl-2-(2-nitrophenylsulfenyl)tryptophan methyl ester is 109064-70-2.
What is the molecular formula of H-Lysyl-2-(2-nitrophenylsulfenyl)tryptophan methyl ester?
The molecular formula of H-Lysyl-2-(2-nitrophenylsulfenyl)tryptophan methyl ester is C24H29N5O5S.
What is the molecular weight of H-Lysyl-2-(2-nitrophenylsulfenyl)tryptophan methyl ester?
The molecular weight of H-Lysyl-2-(2-nitrophenylsulfenyl)tryptophan methyl ester is 499.19 g/mol.
Where can I buy H-Lysyl-2-(2-nitrophenylsulfenyl)tryptophan methyl ester?
You can request a quote for H-Lysyl-2-(2-nitrophenylsulfenyl)tryptophan methyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for H-Lysyl-2-(2-nitrophenylsulfenyl)tryptophan methyl ester?
Yes, KEHONG BIO provides custom synthesis services for H-Lysyl-2-(2-nitrophenylsulfenyl)tryptophan methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.