Hsal-chlorambucil
TL;DR: Hsal-chlorambucil (CAS 694-32-6) is a chemical compound with molecular formula C33H48Cl2N2O3 and molecular weight 590.30 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(4aS,4bR,6aS,8S,10aS,10bS,12aS)-10a,12a-dimethyl-2-oxo-3,4,4a,4b,5,6,6a,7,8,9,10,10b,11,12-tetradecahydro-1H-naphtho[2,1-f]quinolin-8-yl] 4-[4-[bis(2-chloroethyl)amino]phenyl]butanoate
Also Known As: Hsal-chlorambucil, KST-1A7606, [(4aS,4bR,6aS,8S,10aS,10bS,12aS)-10a,12a-dimethyl-2-oxo-3,4,4a,4b,5,6,6a,7,8,9,10,10b,11,12-tetradecahydro-1H-naphtho[2,1-f]quinolin-8-yl] 4-[4-[bis(2-chloroethyl)amino]phenyl]butanoate, (4as,4br,6as,8s,10as,10bs,12as)-10a,12a-dimethyl-2-oxooctadecahydronaphtho[2,1-f]quinolin-8-yl 4-{4-[bis(2-chloroethyl)amino]phenyl}butanoate, 3-Hydroxy-13,17-secoandrostan-17-oic-13,17-lactam (4-(bis(2-chloroethyl)amino)phenyl)butyrate
| Molecular Formula | C33H48Cl2N2O3 |
|---|---|
| Molecular Weight | 590.30 g/mol |
| LogP | 7.2 |
| Topological Polar Surface Area | 58.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 11 |
| Exact Mass | 590.3042 |
| Heavy Atoms | 40 |
| Complexity | 874.0 |
Chemical Identifiers
| CAS Number | 694-32-6 |
|---|---|
| SMILES | C[C@]12CC[C@@H](C[C@@H]1CC[C@@H]3[C@@H]2CC[C@]4([C@H]3CCC(=O)N4)C)OC(=O)CCCC5=CC=C(C=C5)N(CCCl)CCCl |
| InChIKey | RZUXNVWHBNYWOU-YFZVQILUSA-N |
Product Overview
Hsal-chlorambucil (CAS 694-32-6), with molecular formula C33H48Cl2N2O3 and molecular weight 590.30 g/mol. IUPAC: [(4aS,4bR,6aS,8S,10aS,10bS,12aS)-10a,12a-dimethyl-2-oxo-3,4,4a,4b,5,6,6a,7,8,9,10,10b,11,12-tetradecahydro-1H-naphtho[2,1-f]quinolin-8-yl] 4-[4-[bis(2-chloroethyl)amino]phenyl]butanoate.
Chemical Property Profile of Hsal-chlorambucil
Property Insights of Hsal-chlorambucil
The XLogP value of 7.2 indicates that Hsal-chlorambucil is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.6 Ų, Hsal-chlorambucil exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Hsal-chlorambucil has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Hsal-chlorambucil?
The CAS number of Hsal-chlorambucil is 694-32-6.
What is the molecular formula of Hsal-chlorambucil?
The molecular formula of Hsal-chlorambucil is C33H48Cl2N2O3.
What is the molecular weight of Hsal-chlorambucil?
The molecular weight of Hsal-chlorambucil is 590.30 g/mol.
Where can I buy Hsal-chlorambucil?
You can request a quote for Hsal-chlorambucil directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hsal-chlorambucil?
Yes, KEHONG BIO provides custom synthesis services for Hsal-chlorambucil and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.