Crixivan analog
TL;DR: Crixivan analog (CAS 181869-07-8) is a chemical compound with molecular formula C28H31NO5S and molecular weight 493.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R,4S)-2-benzyl-4-hydroxy-N-[(2R)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]-5-(2-methylsulfonylphenyl)pentanamide
Also Known As: Crixivan analog, (2R,4S)-2-benzyl-4-hydroxy-N-[(2R)-2-hydroxyindan-1-yl]-5-(2-methylsulfonylphenyl)pentanamide, Benzenepentanamide, N-(2,3-dihydro-2-hydroxy-1H-inden-1-yl)-gamma-hydroxy-2-(methylsulfonyl)-alpha-(phenylmethyl)-, (1S-(1a(aS*,gR*),2a))-, (2R,4S)-2-Benzyl-4-hydroxy-N-[(2R)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]-5-[2-(methanesulfonyl)phenyl]pentanimidic acid, (2S,4S)-2-benzyl-4-hydroxy-N-[(2R)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]-5-(2-methylsulfonylphenyl)pentanamide
| Molecular Formula | C28H31NO5S |
|---|---|
| Molecular Weight | 493.19 g/mol |
| LogP | 3.017 |
| Topological Polar Surface Area | 103.7 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 493.1923 |
| Heavy Atoms | 35 |
| Complexity | 1275.2699 |
Chemical Identifiers
| CAS Number | 181869-07-8 |
|---|---|
| SMILES | CS(=O)(=O)C1=CC=CC=C1C[C@H](C[C@@H](CC2=CC=CC=C2)C(=O)NC3[C@@H](CC4=CC=CC=C34)O)O |
Product Overview
Crixivan analog (CAS 181869-07-8), with molecular formula C28H31NO5S and molecular weight 493.19 g/mol. IUPAC: (2R,4S)-2-benzyl-4-hydroxy-N-[(2R)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]-5-(2-methylsulfonylphenyl)pentanamide.
Chemical Property Profile of Crixivan analog
Property Insights of Crixivan analog
The XLogP value of 3.017 indicates that Crixivan analog is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 103.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Crixivan analog. Following Lipinski's Rule of Five, Crixivan analog has 3 hydrogen bond donor(s) and 5 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 Crixivan analog?
The CAS number of Crixivan analog is 181869-07-8.
What is the molecular formula of Crixivan analog?
The molecular formula of Crixivan analog is C28H31NO5S.
What is the molecular weight of Crixivan analog?
The molecular weight of Crixivan analog is 493.19 g/mol.
Where can I buy Crixivan analog?
You can request a quote for Crixivan analog directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Crixivan analog?
Yes, KEHONG BIO provides custom synthesis services for Crixivan analog and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.