![2,10,12-triaza-9-(6-chloro-2-fluorophenyl)-5,5-dimethyltricyclo[9.4.0.0<3,8>]pentadeca-1(15),3(8),11(12),13-tetraen-7-one structure](/static/products/1022/1022505-60-7.webp)
2,10,12-triaza-9-(6-chloro-2-fluorophenyl)-5,5-dimethyltricyclo[9.4.0.0<3,8>]pentadeca-1(15),3(8),11(12),13-tetraen-7-one
TL;DR: 2,10,12-triaza-9-(6-chloro-2-fluorophenyl)-5,5-dimethyltricyclo[9.4.0.0<3,8>]pentadeca-1(15),3(8),11(12),13-tetraen-7-one (CAS 1022505-60-7) is a chemical compound with molecular formula C20H19ClFN3O and molecular weight 371.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(2-chloro-6-fluorophenyl)-9,9-dimethyl-6,8,10,11-tetrahydro-5H-pyrido[3,2-b][1,4]benzodiazepin-7-one
Also Known As: 2,10,12-triaza-9-(6-chloro-2-fluorophenyl)-5,5-dimethyltricyclo[9.4.0.0<3,8>]pentadeca-1(15),3(8),11(12),13-tetraen-7-one, 6-(2-chloro-6-fluorophenyl)-9,9-dimethyl-6,8,10,11-tetrahydro-5H-pyrido[3,2-b][1,4]benzodiazepin-7-one, 10-(2-chloro-6-fluorophenyl)-14,14-dimethyl-2,7,9-triazatricyclo[9.4.0.0^{3,8}]pentadeca-1(11),3,5,7-tetraen-12-one, 6-(2-chloro-6-fluoro-phenyl)-9,9-dimethyl-6,8,10,11-tetrahydro-5H-pyrido[3,2-b][1,4]benzodiazepin-7-one, C20H19ClFN3O
| Molecular Formula | C20H19ClFN3O |
|---|---|
| Molecular Weight | 371.12 g/mol |
| LogP | 5.096 |
| Topological Polar Surface Area | 54.02 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 371.12006 |
| Heavy Atoms | 26 |
| Complexity | 918.15356 |
Chemical Identifiers
| CAS Number | 1022505-60-7 |
|---|---|
| SMILES | CC1(CC2=C(C(NC3=C(N2)C=CC=N3)C4=C(C=CC=C4Cl)F)C(=O)C1)C |
Product Overview
2,10,12-triaza-9-(6-chloro-2-fluorophenyl)-5,5-dimethyltricyclo[9.4.0.0<3,8>]pentadeca-1(15),3(8),11(12),13-tetraen-7-one (CAS 1022505-60-7), with molecular formula C20H19ClFN3O and molecular weight 371.12 g/mol. IUPAC: 6-(2-chloro-6-fluorophenyl)-9,9-dimethyl-6,8,10,11-tetrahydro-5H-pyrido[3,2-b][1,4]benzodiazepin-7-one.
Chemical Property Profile of 2,10,12-triaza-9-(6-chloro-2-fluorophenyl)-5,5-dimethyltricyclo[9.4.0.0<3,8>]pentadeca-1(15),3(8),11(12),13-tetraen-7-one
Property Insights of 2,10,12-triaza-9-(6-chloro-2-fluorophenyl)-5,5-dimethyltricyclo[9.4.0.0<3,8>]pentadeca-1(15),3(8),11(12),13-tetraen-7-one
The XLogP value of 5.096 indicates that 2,10,12-triaza-9-(6-chloro-2-fluorophenyl)-5,5-dimethyltricyclo[9.4.0.0<3,8>]pentadeca-1(15),3(8),11(12),13-tetraen-7-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.02 Ų, 2,10,12-triaza-9-(6-chloro-2-fluorophenyl)-5,5-dimethyltricyclo[9.4.0.0<3,8>]pentadeca-1(15),3(8),11(12),13-tetraen-7-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,10,12-triaza-9-(6-chloro-2-fluorophenyl)-5,5-dimethyltricyclo[9.4.0.0<3,8>]pentadeca-1(15),3(8),11(12),13-tetraen-7-one has 2 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 2,10,12-triaza-9-(6-chloro-2-fluorophenyl)-5,5-dimethyltricyclo[9.4.0.0<3,8>]pentadeca-1(15),3(8),11(12),13-tetraen-7-one?
The CAS number of 2,10,12-triaza-9-(6-chloro-2-fluorophenyl)-5,5-dimethyltricyclo[9.4.0.0<3,8>]pentadeca-1(15),3(8),11(12),13-tetraen-7-one is 1022505-60-7.
What is the molecular formula of 2,10,12-triaza-9-(6-chloro-2-fluorophenyl)-5,5-dimethyltricyclo[9.4.0.0<3,8>]pentadeca-1(15),3(8),11(12),13-tetraen-7-one?
The molecular formula of 2,10,12-triaza-9-(6-chloro-2-fluorophenyl)-5,5-dimethyltricyclo[9.4.0.0<3,8>]pentadeca-1(15),3(8),11(12),13-tetraen-7-one is C20H19ClFN3O.
What is the molecular weight of 2,10,12-triaza-9-(6-chloro-2-fluorophenyl)-5,5-dimethyltricyclo[9.4.0.0<3,8>]pentadeca-1(15),3(8),11(12),13-tetraen-7-one?
The molecular weight of 2,10,12-triaza-9-(6-chloro-2-fluorophenyl)-5,5-dimethyltricyclo[9.4.0.0<3,8>]pentadeca-1(15),3(8),11(12),13-tetraen-7-one is 371.12 g/mol.
Where can I buy 2,10,12-triaza-9-(6-chloro-2-fluorophenyl)-5,5-dimethyltricyclo[9.4.0.0<3,8>]pentadeca-1(15),3(8),11(12),13-tetraen-7-one?
You can request a quote for 2,10,12-triaza-9-(6-chloro-2-fluorophenyl)-5,5-dimethyltricyclo[9.4.0.0<3,8>]pentadeca-1(15),3(8),11(12),13-tetraen-7-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,10,12-triaza-9-(6-chloro-2-fluorophenyl)-5,5-dimethyltricyclo[9.4.0.0<3,8>]pentadeca-1(15),3(8),11(12),13-tetraen-7-one?
Yes, KEHONG BIO provides custom synthesis services for 2,10,12-triaza-9-(6-chloro-2-fluorophenyl)-5,5-dimethyltricyclo[9.4.0.0<3,8>]pentadeca-1(15),3(8),11(12),13-tetraen-7-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.