C15H21ClN2O2.1/2H2O
TL;DR: C15H21ClN2O2.1/2H2O (CAS 124500-18-1) is a chemical compound with molecular formula C15H21ClN2O2 and molecular weight 296.12915 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-(4-chlorophenyl)-4-hydroxy-2-(pyrrolidin-1-ylmethyl)butanamide
Also Known As: C15H21ClN2O2.1/2H2O, alpha-(2-(4-Chlorophenyl)-2-hydroxyethyl)-1-pyrrolidinepropanamide hydrate (2:1), C15-H21-Cl-N2-O2.1/2H2-O, 1-Pyrrolidinepropanamide, alpha-(2-(4-chlorophenyl)-2-hydroxyethyl)-, hydrate (2:1), 4-(4-chlorophenyl)-4-hydroxy-2-(pyrrolidin-1-ylmethyl)butanamide
Technical Specifications
| Molecular Formula | C15H21ClN2O2 |
| Molecular Weight | 296.12915 g/mol |
| XLogP | 1.5 |
| Topological Polar Surface Area (TPSA) | 66.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 296.12915 Da |
| Heavy Atoms | 20 |
| Complexity | 313.0 |
| SMILES | C1CCN(C1)CC(CC(C2=CC=C(C=C2)Cl)O)C(=O)N |
| InChIKey | ZLLBBRDYTZVAEZ-UHFFFAOYSA-N |
Chemical Property Profile of C15H21ClN2O2.1/2H2O
Property Insights of C15H21ClN2O2.1/2H2O
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for C15H21ClN2O2.1/2H2O. The TPSA of 66.6 Ų falls within the moderate polarity range, balancing permeability and solubility for C15H21ClN2O2.1/2H2O. Following Lipinski's Rule of Five, C15H21ClN2O2.1/2H2O has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of C15H21ClN2O2.1/2H2O?
The CAS number of C15H21ClN2O2.1/2H2O is 124500-18-1.
What is the molecular formula of C15H21ClN2O2.1/2H2O?
The molecular formula of C15H21ClN2O2.1/2H2O is C15H21ClN2O2.
What is the molecular weight of C15H21ClN2O2.1/2H2O?
The molecular weight of C15H21ClN2O2.1/2H2O is 296.12915 g/mol.
Where can I buy C15H21ClN2O2.1/2H2O?
You can request a quote for C15H21ClN2O2.1/2H2O directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for C15H21ClN2O2.1/2H2O?
Yes, CoreyChem provides custom synthesis services for C15H21ClN2O2.1/2H2O and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.