nchembio756-comp4
TL;DR: nchembio756-comp4 (CAS 2260917-67-5) is a chemical compound with molecular formula C29H31N7O9 and molecular weight 621.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,4R)-2-amino-4-[4-[[2-[4-[[4-[[2-(2,5-dioxopyrrol-1-yl)acetyl]amino]phenyl]diazenyl]anilino]-2-oxoethyl]amino]-4-oxobutyl]pentanedioic acid
Also Known As: nchembio756-comp4, J2.399.596D, J3.314.441E, (2R,4S)-2-Amino-4-(3-(((4-(4-(2-(2,5-dioxo-2,5-dihydro-pyrrol-1-yl)-acetylamino)-phenylazo)-phenylcarbamoyl)-methyl)-carbamoyl)-propyl)-pentanedioic acid, (2S,4R)-2-amino-4-(3-{[({4-[(1E)-2-{4-[2-(2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)acetamido]phenyl}diazen-1-yl]phenyl}carbamoyl)methyl]carbamoyl}propyl)pentanedioic acid
| Molecular Formula | C29H31N7O9 |
|---|---|
| Molecular Weight | 621.22 g/mol |
| LogP | 1.6933 |
| Topological Polar Surface Area | 250.02 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 16 |
| Exact Mass | 621.2183 |
| Heavy Atoms | 45 |
| Complexity | 1486.9578 |
Chemical Identifiers
| CAS Number | 2260917-67-5 |
|---|---|
| SMILES | C1=CC(=CC=C1NC(=O)CNC(=O)CCC[C@H](C[C@@H](C(=O)O)N)C(=O)O)N=NC2=CC=C(C=C2)NC(=O)CN3C(=O)C=CC3=O |
Product Overview
nchembio756-comp4 (CAS 2260917-67-5), with molecular formula C29H31N7O9 and molecular weight 621.22 g/mol. IUPAC: (2S,4R)-2-amino-4-[4-[[2-[4-[[4-[[2-(2,5-dioxopyrrol-1-yl)acetyl]amino]phenyl]diazenyl]anilino]-2-oxoethyl]amino]-4-oxobutyl]pentanedioic acid.
Chemical Property Profile of nchembio756-comp4
Property Insights of nchembio756-comp4
The XLogP value of 1.6933 suggests moderate lipophilicity, balancing water solubility and membrane permeability for nchembio756-comp4. The TPSA of 250.02 Ų indicates high polarity, suggesting nchembio756-comp4 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, nchembio756-comp4 has 6 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of nchembio756-comp4?
The CAS number of nchembio756-comp4 is 2260917-67-5.
What is the molecular formula of nchembio756-comp4?
The molecular formula of nchembio756-comp4 is C29H31N7O9.
What is the molecular weight of nchembio756-comp4?
The molecular weight of nchembio756-comp4 is 621.22 g/mol.
Where can I buy nchembio756-comp4?
You can request a quote for nchembio756-comp4 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for nchembio756-comp4?
Yes, KEHONG BIO provides custom synthesis services for nchembio756-comp4 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.