Hydroxy chlorambucil
TL;DR: Hydroxy chlorambucil (CAS 27171-89-7) is a chemical compound with molecular formula C14H20ClNO3 and molecular weight 285.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[4-[2-chloroethyl(2-hydroxyethyl)amino]phenyl]butanoic acid
Also Known As: Hydroxy chlorambucil, Chlorambucil Impurity A, Chlorambucil EP Impurity A, N-(2-Hydroxyethyl) Chlorambucil, N-(2-Hydroxyethyl)Chlorambucil
| Molecular Formula | C14H20ClNO3 |
|---|---|
| Molecular Weight | 285.11 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 60.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 285.11316 |
| Heavy Atoms | 19 |
| Complexity | 255.0 |
Chemical Identifiers
| CAS Number | 27171-89-7 |
|---|---|
| SMILES | C1=CC(=CC=C1CCCC(=O)O)N(CCO)CCCl |
| InChIKey | SFCORMODVLBZLW-UHFFFAOYSA-N |
Product Overview
Hydroxy chlorambucil (CAS 27171-89-7), with molecular formula C14H20ClNO3 and molecular weight 285.11 g/mol. IUPAC: 4-[4-[2-chloroethyl(2-hydroxyethyl)amino]phenyl]butanoic acid.
Chemical Property Profile of Hydroxy chlorambucil
Property Insights of Hydroxy chlorambucil
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Hydroxy chlorambucil. The TPSA of 60.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Hydroxy chlorambucil. Following Lipinski's Rule of Five, Hydroxy chlorambucil has 2 hydrogen bond donor(s) and 4 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 Hydroxy chlorambucil?
The CAS number of Hydroxy chlorambucil is 27171-89-7.
What is the molecular formula of Hydroxy chlorambucil?
The molecular formula of Hydroxy chlorambucil is C14H20ClNO3.
What is the molecular weight of Hydroxy chlorambucil?
The molecular weight of Hydroxy chlorambucil is 285.11 g/mol.
Where can I buy Hydroxy chlorambucil?
You can request a quote for Hydroxy chlorambucil directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hydroxy chlorambucil?
Yes, KEHONG BIO provides custom synthesis services for Hydroxy chlorambucil and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.