二氢西汀
TL;DR: 二氢西汀 (CAS 757161-85-6) is a chemical compound with molecular formula C17H17NO2 and molecular weight 267.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
二氢西汀
(6aS,12bR)-5,6,6a,7,8,12b-hexahydrobenzo[a]phenanthridine-10,11-diol
Also Known As: DIHYDREXIDINE, (+)-Dihydrexidine, (-)-Dihydrexidine, Dihydrexidine, (-)-, DAR0100A
| Molecular Formula | C17H17NO2 |
|---|---|
| Molecular Weight | 267.13 g/mol |
| LogP | 2.6477 |
| Topological Polar Surface Area | 52.49 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 267.12592 |
| Heavy Atoms | 20 |
| Complexity | 680.68536 |
Chemical Identifiers
| CAS Number | 757161-85-6 |
|---|---|
| SMILES | C1CC2=CC(=C(C=C2[C@H]3[C@H]1NCC4=CC=CC=C34)O)O |
Product Overview
二氢西汀 (CAS 757161-85-6), with molecular formula C17H17NO2 and molecular weight 267.13 g/mol. IUPAC: (6aS,12bR)-5,6,6a,7,8,12b-hexahydrobenzo[a]phenanthridine-10,11-diol.
Chemical Property Profile of 二氢西汀
Property Insights of 二氢西汀
The XLogP value of 2.6477 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 二氢西汀. With a topological polar surface area (TPSA) of 52.49 Ų, 二氢西汀 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 二氢西汀 has 3 hydrogen bond donor(s) and 3 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 二氢西汀?
The CAS number of 二氢西汀 is 757161-85-6.
What is the molecular formula of 二氢西汀?
The molecular formula of 二氢西汀 is C17H17NO2.
What is the molecular weight of 二氢西汀?
The molecular weight of 二氢西汀 is 267.13 g/mol.
Where can I buy 二氢西汀?
You can request a quote for 二氢西汀 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 二氢西汀?
Yes, KEHONG BIO provides custom synthesis services for 二氢西汀 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.