AB00100840-01
TL;DR: AB00100840-01 (CAS 311329-34-7) is a chemical compound with molecular formula C25H19N5OS2 and molecular weight 469.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(5-ethyl-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-1-phenothiazin-10-ylethanone
Also Known As: AB00100840-01, A1312/0059637, 2-[(5-ethyl-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-1-phenothiazin-10-ylethanone, 10-{[(5-ethyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)thio]acetyl}-10H-phenothiazine, 2-({5-ETHYL-5H-[1,2,4]TRIAZINO[5,6-B]INDOL-3-YL}SULFANYL)-1-(10H-PHENOTHIAZIN-10-YL)ETHAN-1-ONE
| Molecular Formula | C25H19N5OS2 |
|---|---|
| Molecular Weight | 469.10 g/mol |
| LogP | 5.921 |
| Topological Polar Surface Area | 63.91 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 469.1031 |
| Heavy Atoms | 33 |
| Complexity | 1484.8706 |
Chemical Identifiers
| CAS Number | 311329-34-7 |
|---|---|
| SMILES | CCN1C2=CC=CC=C2C3=C1N=C(N=N3)SCC(=O)N4C5=CC=CC=C5SC6=CC=CC=C64 |
Product Overview
AB00100840-01 (CAS 311329-34-7), with molecular formula C25H19N5OS2 and molecular weight 469.10 g/mol. IUPAC: 2-[(5-ethyl-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-1-phenothiazin-10-ylethanone.
Chemical Property Profile of AB00100840-01
Property Insights of AB00100840-01
The XLogP value of 5.921 indicates that AB00100840-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.91 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00100840-01. Following Lipinski's Rule of Five, AB00100840-01 has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AB00100840-01?
The CAS number of AB00100840-01 is 311329-34-7.
What is the molecular formula of AB00100840-01?
The molecular formula of AB00100840-01 is C25H19N5OS2.
What is the molecular weight of AB00100840-01?
The molecular weight of AB00100840-01 is 469.10 g/mol.
Where can I buy AB00100840-01?
You can request a quote for AB00100840-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00100840-01?
Yes, KEHONG BIO provides custom synthesis services for AB00100840-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.