AN-655/13602017
TL;DR: AN-655/13602017 (CAS 690669-06-8) is a chemical compound with molecular formula C18H16N4OS2 and molecular weight 368.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(3-methylthiophen-2-yl)-3-prop-2-enylsulfanyl-6,7-dihydro-[1,2,4]triazino[5,6-d][3,1]benzoxazepine
Also Known As: AN-655/13602017, 6-(3-methylthiophen-2-yl)-3-prop-2-enylsulfanyl-6,7-dihydro-[1,2,4]triazino[5,6-d][3,1]benzoxazepine, allyl6-(3-methyl-2-thienyl)-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepin-3-ylsulfide, 3-(ALLYLSULFANYL)-6-(3-METHYL-2-THIENYL)-6,7-DIHYDRO[1,2,4]TRIAZINO[5,6-D][3,1]BENZOXAZEPINE
| Molecular Formula | C18H16N4OS2 |
|---|---|
| Molecular Weight | 368.08 g/mol |
| LogP | 4.68972 |
| Topological Polar Surface Area | 59.93 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 368.07657 |
| Heavy Atoms | 25 |
| Complexity | 924.94446 |
Chemical Identifiers
| CAS Number | 690669-06-8 |
|---|---|
| SMILES | CC1=C(SC=C1)C2NC3=CC=CC=C3C4=C(O2)N=C(N=N4)SCC=C |
Product Overview
AN-655/13602017 (CAS 690669-06-8), with molecular formula C18H16N4OS2 and molecular weight 368.08 g/mol. IUPAC: 6-(3-methylthiophen-2-yl)-3-prop-2-enylsulfanyl-6,7-dihydro-[1,2,4]triazino[5,6-d][3,1]benzoxazepine.
Chemical Property Profile of AN-655/13602017
Property Insights of AN-655/13602017
The XLogP value of 4.68972 indicates that AN-655/13602017 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.93 Ų, AN-655/13602017 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AN-655/13602017 has 1 hydrogen bond donor(s) and 7 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 AN-655/13602017?
The CAS number of AN-655/13602017 is 690669-06-8.
What is the molecular formula of AN-655/13602017?
The molecular formula of AN-655/13602017 is C18H16N4OS2.
What is the molecular weight of AN-655/13602017?
The molecular weight of AN-655/13602017 is 368.08 g/mol.
Where can I buy AN-655/13602017?
You can request a quote for AN-655/13602017 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AN-655/13602017?
Yes, KEHONG BIO provides custom synthesis services for AN-655/13602017 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.