BIM-0027470.P001
TL;DR: BIM-0027470.P001 (CAS 328271-68-7) 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-butylsulfanyl-6-[(E)-2-phenylethenyl]-6,7-dihydro-[1,2,4]triazino[5,6-d][3,1]benzoxazepine
Also Known As: BIM-0027470.P001, 3-butylsulfanyl-6-[(E)-2-phenylethenyl]-6,7-dihydro-[1,2,4]triazino[5,6-d][3,1]benzoxazepine, butyl 6-(2-phenylvinyl)-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepin-3-yl sulfide, 3-(BUTYLSULFANYL)-6-[(E)-2-PHENYL-1-ETHENYL]-6,7-DIHYDRO[1,2,4]TRIAZINO[5,6-D][3,1]BENZOXAZEPINE
| Molecular Formula | C22H22N4OS |
|---|---|
| Molecular Weight | 390.15 g/mol |
| LogP | 5.2746 |
| Topological Polar Surface Area | 59.93 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 390.15143 |
| Heavy Atoms | 28 |
| Complexity | 961.7604 |
Chemical Identifiers
| CAS Number | 328271-68-7 |
|---|---|
| SMILES | CCCCSC1=NC2=C(C3=CC=CC=C3NC(O2)/C=C/C4=CC=CC=C4)N=N1 |
Product Overview
BIM-0027470.P001 (CAS 328271-68-7), with molecular formula C22H22N4OS and molecular weight 390.15 g/mol. IUPAC: 3-butylsulfanyl-6-[(E)-2-phenylethenyl]-6,7-dihydro-[1,2,4]triazino[5,6-d][3,1]benzoxazepine.
Chemical Property Profile of BIM-0027470.P001
Property Insights of BIM-0027470.P001
The XLogP value of 5.2746 indicates that BIM-0027470.P001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.93 Ų, BIM-0027470.P001 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BIM-0027470.P001 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 BIM-0027470.P001?
The CAS number of BIM-0027470.P001 is 328271-68-7.
What is the molecular formula of BIM-0027470.P001?
The molecular formula of BIM-0027470.P001 is C22H22N4OS.
What is the molecular weight of BIM-0027470.P001?
The molecular weight of BIM-0027470.P001 is 390.15 g/mol.
Where can I buy BIM-0027470.P001?
You can request a quote for BIM-0027470.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0027470.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0027470.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.