J2.029.979G
TL;DR: J2.029.979G (CAS 623563-74-6) is a chemical compound with molecular formula C32H41N3O11 and molecular weight 643.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(cyclopropylamino)-2-[4-[(2S)-3-[4-(3-hydroxy-2-methoxycarbonylphenoxy)butylamino]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]phenoxy]-3-oxopropanoic acid
Also Known As: J2.029.979G, Benzoic acid,2-[4-[[(2S)-3-[4-[1-carboxy-2-(cyclopropylamino)-2-oxoethoxy]phenyl]-2-[[(1,1-dimethylethoxy)carbonyl]amino]-1-oxopropyl]aMino]butoxy]-6-hydroxy-,1-Methyl ester, 2-(4-((S)-2-(tert-butoxycarbonylamino)-3-(4-(3-hydroxy-2-(methoxycarbonyl)phenoxy)butylamino)-3-oxopropyl)phenoxy)-3-(cyclopropylamino)-3-oxopropanoic acid, 2-{4-[(2S)-2-{[(tert-butoxy)carbonyl]amino}-2-({4-[3-hydroxy-2-(methoxycarbonyl)phenoxy]butyl}carbamoyl)ethyl]phenoxy}-2-(cyclopropylcarbamoyl)acetic acid, 2-Hydroxy-6-[4-[N-(tert-butoxycarbonyl)-4-[1-(hydroxycarbonyl)-2-oxo-2-(cyclopropylamino)ethoxy]-L-phenylalanylamino]butoxy]benzoic acid methyl ester
| Molecular Formula | C32H41N3O11 |
|---|---|
| Molecular Weight | 643.27 g/mol |
| LogP | 2.7006 |
| Topological Polar Surface Area | 198.82 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 16 |
| Exact Mass | 643.2741 |
| Heavy Atoms | 46 |
| Complexity | 1384.6726 |
Chemical Identifiers
| CAS Number | 623563-74-6 |
|---|---|
| SMILES | CC(C)(C)OC(=O)N[C@@H](CC1=CC=C(C=C1)OC(C(=O)NC2CC2)C(=O)O)C(=O)NCCCCOC3=CC=CC(=C3C(=O)OC)O |
Product Overview
J2.029.979G (CAS 623563-74-6), with molecular formula C32H41N3O11 and molecular weight 643.27 g/mol. IUPAC: 3-(cyclopropylamino)-2-[4-[(2S)-3-[4-(3-hydroxy-2-methoxycarbonylphenoxy)butylamino]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]phenoxy]-3-oxopropanoic acid.
Chemical Property Profile of J2.029.979G
Property Insights of J2.029.979G
The XLogP value of 2.7006 suggests moderate lipophilicity, balancing water solubility and membrane permeability for J2.029.979G. The TPSA of 198.82 Ų indicates high polarity, suggesting J2.029.979G may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, J2.029.979G has 5 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 J2.029.979G?
The CAS number of J2.029.979G is 623563-74-6.
What is the molecular formula of J2.029.979G?
The molecular formula of J2.029.979G is C32H41N3O11.
What is the molecular weight of J2.029.979G?
The molecular weight of J2.029.979G is 643.27 g/mol.
Where can I buy J2.029.979G?
You can request a quote for J2.029.979G directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for J2.029.979G?
Yes, KEHONG BIO provides custom synthesis services for J2.029.979G and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.