AN-655/14906003
TL;DR: AN-655/14906003 (CAS 354786-62-2) is a chemical compound with molecular formula C22H22N4OS and molecular weight 390.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(4-methylphenyl)methylsulfanyl]spiro[7H-[1,2,4]triazino[5,6-d][3,1]benzoxazepine-6,1'-cyclopentane]
Also Known As: AN-655/14906003, 3-[(4-methylphenyl)methylsulfanyl]spiro[7H-[1,2,4]triazino[5,6-d][3,1]benzoxazepine-6,1'-cyclopentane], 3-[(methylbenzyl)sulfanyl]-6,7-dihydrospiro([1,2,4]triazino[5,6-d][3,1]benzoxazepine-6,1'-cyclopentane), 3'-[(4-methylbenzyl)thio]-7'H-spiro[cyclopentane-1,6'-[1,2,4]triazino[5,6-d][3,1]benzoxazepine]
| Molecular Formula | C22H22N4OS |
|---|---|
| Molecular Weight | 390.15 g/mol |
| LogP | 5.21392 |
| Topological Polar Surface Area | 59.93 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 390.15143 |
| Heavy Atoms | 28 |
| Complexity | 999.6735 |
Chemical Identifiers
| CAS Number | 354786-62-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)CSC2=NC3=C(C4=CC=CC=C4NC5(O3)CCCC5)N=N2 |
Product Overview
AN-655/14906003 (CAS 354786-62-2), with molecular formula C22H22N4OS and molecular weight 390.15 g/mol. IUPAC: 3-[(4-methylphenyl)methylsulfanyl]spiro[7H-[1,2,4]triazino[5,6-d][3,1]benzoxazepine-6,1'-cyclopentane].
Chemical Property Profile of AN-655/14906003
Property Insights of AN-655/14906003
The XLogP value of 5.21392 indicates that AN-655/14906003 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-655/14906003 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AN-655/14906003 has 1 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 AN-655/14906003?
The CAS number of AN-655/14906003 is 354786-62-2.
What is the molecular formula of AN-655/14906003?
The molecular formula of AN-655/14906003 is C22H22N4OS.
What is the molecular weight of AN-655/14906003?
The molecular weight of AN-655/14906003 is 390.15 g/mol.
Where can I buy AN-655/14906003?
You can request a quote for AN-655/14906003 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AN-655/14906003?
Yes, KEHONG BIO provides custom synthesis services for AN-655/14906003 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.