AB01286752-01
TL;DR: AB01286752-01 (CAS 912800-90-9) is a chemical compound with molecular formula C16H15F3N2O2 and molecular weight 324.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[3-(trifluoromethyl)phenyl]-5,6,7,8-tetrahydro-4H-cyclohepta[d][1,2]oxazole-3-carboxamide
Also Known As: AB01286752-01, N-[3-(trifluoromethyl)phenyl]-5,6,7,8-tetrahydro-4H-cyclohepta[d][1,2]oxazole-3-carboxamide, N-(3-(trifluoromethyl)phenyl)-5,6,7,8-tetrahydro-4H-cyclohepta[d]isoxazole-3-carboxamide, N-[3-(trifluoromethyl)phenyl]-8-oxa-9-azabicyclo[5.3.0]deca-9,11-diene-10-carboxamide, 4,5,6,7,8-pentahydrocyclohepta[2,1-d]isoxazol-3-yl-N-[3-(trifluoromethyl)pheny l]carboxamide
| Molecular Formula | C16H15F3N2O2 |
|---|---|
| Molecular Weight | 324.11 g/mol |
| LogP | 4.2146 |
| Topological Polar Surface Area | 55.13 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 324.10855 |
| Heavy Atoms | 23 |
| Complexity | 722.3557 |
Chemical Identifiers
| CAS Number | 912800-90-9 |
|---|---|
| SMILES | C1CCC2=C(CC1)ON=C2C(=O)NC3=CC=CC(=C3)C(F)(F)F |
Product Overview
AB01286752-01 (CAS 912800-90-9), with molecular formula C16H15F3N2O2 and molecular weight 324.11 g/mol. IUPAC: N-[3-(trifluoromethyl)phenyl]-5,6,7,8-tetrahydro-4H-cyclohepta[d][1,2]oxazole-3-carboxamide.
Chemical Property Profile of AB01286752-01
Property Insights of AB01286752-01
The XLogP value of 4.2146 indicates that AB01286752-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.13 Ų, AB01286752-01 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AB01286752-01 has 1 hydrogen bond donor(s) and 3 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 AB01286752-01?
The CAS number of AB01286752-01 is 912800-90-9.
What is the molecular formula of AB01286752-01?
The molecular formula of AB01286752-01 is C16H15F3N2O2.
What is the molecular weight of AB01286752-01?
The molecular weight of AB01286752-01 is 324.11 g/mol.
Where can I buy AB01286752-01?
You can request a quote for AB01286752-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB01286752-01?
Yes, KEHONG BIO provides custom synthesis services for AB01286752-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.