BAS 06901368
TL;DR: BAS 06901368 (CAS 626221-75-8) is a chemical compound with molecular formula C23H22F3N3OS and molecular weight 445.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[6-amino-8-(trifluoromethyl)-4-thia-2-azatricyclo[7.5.0.03,7]tetradeca-1(9),2,5,7-tetraen-5-yl]-(3,4-dihydro-1H-isoquinolin-2-yl)methanone
Also Known As: BAS 06901368, AM-807/41624102, (3-Amino-4-(trifluoromethyl)-6,7,8,9-tetrahydro-5H-cyclohepta[b]thieno[3,2-e]pyridin-2-yl)(3,4-dihydroisoquinolin-2(1H)-yl)methanone, [6-Amino-8-(trifluoromethyl)-4-thia-2-azatricyclo[7.5.0.03,7]tetradeca-1(9),2,5,7-tetraen-5-yl]-(3,4-dihydro-1H-isoquinolin-2-yl)methanone, 5-(1,2,3,4-tetrahydroisoquinoline-2-carbonyl)-8-(trifluoromethyl)-4-thia-2-azatricyclo[7.5.0.0^{3,7}]tetradeca-1(9),2,5,7-tetraen-6-amine
| Molecular Formula | C23H22F3N3OS |
|---|---|
| Molecular Weight | 445.14 g/mol |
| LogP | 5.3647 |
| Topological Polar Surface Area | 59.22 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 445.14355 |
| Heavy Atoms | 31 |
| Complexity | 1185.0039 |
Chemical Identifiers
| CAS Number | 626221-75-8 |
|---|---|
| SMILES | C1CCC2=C(CC1)N=C3C(=C2C(F)(F)F)C(=C(S3)C(=O)N4CCC5=CC=CC=C5C4)N |
Product Overview
BAS 06901368 (CAS 626221-75-8), with molecular formula C23H22F3N3OS and molecular weight 445.14 g/mol. IUPAC: [6-amino-8-(trifluoromethyl)-4-thia-2-azatricyclo[7.5.0.03,7]tetradeca-1(9),2,5,7-tetraen-5-yl]-(3,4-dihydro-1H-isoquinolin-2-yl)methanone.
Chemical Property Profile of BAS 06901368
Property Insights of BAS 06901368
The XLogP value of 5.3647 indicates that BAS 06901368 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.22 Ų, BAS 06901368 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 06901368 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 06901368?
The CAS number of BAS 06901368 is 626221-75-8.
What is the molecular formula of BAS 06901368?
The molecular formula of BAS 06901368 is C23H22F3N3OS.
What is the molecular weight of BAS 06901368?
The molecular weight of BAS 06901368 is 445.14 g/mol.
Where can I buy BAS 06901368?
You can request a quote for BAS 06901368 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 06901368?
Yes, KEHONG BIO provides custom synthesis services for BAS 06901368 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.