AN-655/37437003
TL;DR: AN-655/37437003 (CAS 6636-77-7) is a chemical compound with molecular formula C22H22N4O4S and molecular weight 438.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[6-(2,3-dimethoxyphenyl)-3-methylsulfanyl-6H-[1,2,4]triazino[5,6-d][3,1]benzoxazepin-7-yl]propan-1-one
Also Known As: AN-655/37437003, AB00113350-01, 1-[6-(2,3-dimethoxyphenyl)-3-methylsulfanyl-6H-[1,2,4]triazino[5,6-d][3,1]benzoxazepin-7-yl]propan-1-one, 1-[6-(2,3-dimethoxyphenyl)-3-(methylsulfanyl)[1,2,4]triazino[5,6-d][3,1]benzoxazepin-7(6H)-yl]propan-1-one, 1-[6-(2,3-DIMETHOXYPHENYL)-3-(METHYLSULFANYL)[1,2,4]TRIAZINO[5,6-D][3,1]BENZOXAZEPIN-7(6H)-YL]-1-PROPANONE
| Molecular Formula | C22H22N4O4S |
|---|---|
| Molecular Weight | 438.14 g/mol |
| LogP | 4.1119 |
| Topological Polar Surface Area | 86.67 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 438.13617 |
| Heavy Atoms | 31 |
| Complexity | 1124.415 |
Chemical Identifiers
| CAS Number | 6636-77-7 |
|---|---|
| SMILES | CCC(=O)N1C(OC2=C(C3=CC=CC=C31)N=NC(=N2)SC)C4=C(C(=CC=C4)OC)OC |
Product Overview
AN-655/37437003 (CAS 6636-77-7), with molecular formula C22H22N4O4S and molecular weight 438.14 g/mol. IUPAC: 1-[6-(2,3-dimethoxyphenyl)-3-methylsulfanyl-6H-[1,2,4]triazino[5,6-d][3,1]benzoxazepin-7-yl]propan-1-one.
Chemical Property Profile of AN-655/37437003
Property Insights of AN-655/37437003
The XLogP value of 4.1119 indicates that AN-655/37437003 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.67 Ų falls within the moderate polarity range, balancing permeability and solubility for AN-655/37437003. Following Lipinski's Rule of Five, AN-655/37437003 has 0 hydrogen bond donor(s) and 8 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-655/37437003?
The CAS number of AN-655/37437003 is 6636-77-7.
What is the molecular formula of AN-655/37437003?
The molecular formula of AN-655/37437003 is C22H22N4O4S.
What is the molecular weight of AN-655/37437003?
The molecular weight of AN-655/37437003 is 438.14 g/mol.
Where can I buy AN-655/37437003?
You can request a quote for AN-655/37437003 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AN-655/37437003?
Yes, KEHONG BIO provides custom synthesis services for AN-655/37437003 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.