![2,10,12-triaza-9-benzo[d]1,3-dioxolan-5-yl-5,5-dimethyltricyclo[9.4.0.0<3,8>]pentadeca-1(15),3(8),11(12),13-tetraen-7-one structure](/static/products/7052/705268-90-2.webp)
2,10,12-triaza-9-benzo[d]1,3-dioxolan-5-yl-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-benzo[d]1,3-dioxolan-5-yl-5,5-dimethyltricyclo[9.4.0.0<3,8>]pentadeca-1(15),3(8),11(12),13-tetraen-7-one (CAS 705268-90-2) is a chemical compound with molecular formula C21H21N3O3 and molecular weight 363.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(1,3-benzodioxol-5-yl)-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-benzo[d]1,3-dioxolan-5-yl-5,5-dimethyltricyclo[9.4.0.0<3,8>]pentadeca-1(15),3(8),11(12),13-tetraen-7-one, 6-(1,3-benzodioxol-5-yl)-9,9-dimethyl-6,8,10,11-tetrahydro-5H-pyrido[3,2-b][1,4]benzodiazepin-7-one, 10-(2H-1,3-benzodioxol-5-yl)-14,14-dimethyl-2,7,9-triazatricyclo[9.4.0.0^{3,8}]pentadeca-1(11),3,5,7-tetraen-12-one, 10-(Benzo[d][1,3]dioxol-5-yl)-7,7-dimethyl-5,6,7,8,10,11-hexahydro-9H-benzo[e]pyrido[2,3-b][1,4]diazepin-9-one
| Molecular Formula | C21H21N3O3 |
|---|---|
| Molecular Weight | 363.16 g/mol |
| LogP | 4.0322 |
| Topological Polar Surface Area | 72.48 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 363.1583 |
| Heavy Atoms | 27 |
| Complexity | 980.38715 |
Chemical Identifiers
| CAS Number | 705268-90-2 |
|---|---|
| SMILES | CC1(CC2=C(C(NC3=C(N2)C=CC=N3)C4=CC5=C(C=C4)OCO5)C(=O)C1)C |
Product Overview
2,10,12-triaza-9-benzo[d]1,3-dioxolan-5-yl-5,5-dimethyltricyclo[9.4.0.0<3,8>]pentadeca-1(15),3(8),11(12),13-tetraen-7-one (CAS 705268-90-2), with molecular formula C21H21N3O3 and molecular weight 363.16 g/mol. IUPAC: 6-(1,3-benzodioxol-5-yl)-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-benzo[d]1,3-dioxolan-5-yl-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-benzo[d]1,3-dioxolan-5-yl-5,5-dimethyltricyclo[9.4.0.0<3,8>]pentadeca-1(15),3(8),11(12),13-tetraen-7-one
The XLogP value of 4.0322 indicates that 2,10,12-triaza-9-benzo[d]1,3-dioxolan-5-yl-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. The TPSA of 72.48 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,10,12-triaza-9-benzo[d]1,3-dioxolan-5-yl-5,5-dimethyltricyclo[9.4.0.0<3,8>]pentadeca-1(15),3(8),11(12),13-tetraen-7-one. Following Lipinski's Rule of Five, 2,10,12-triaza-9-benzo[d]1,3-dioxolan-5-yl-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 6 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 2,10,12-triaza-9-benzo[d]1,3-dioxolan-5-yl-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-benzo[d]1,3-dioxolan-5-yl-5,5-dimethyltricyclo[9.4.0.0<3,8>]pentadeca-1(15),3(8),11(12),13-tetraen-7-one is 705268-90-2.
What is the molecular formula of 2,10,12-triaza-9-benzo[d]1,3-dioxolan-5-yl-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-benzo[d]1,3-dioxolan-5-yl-5,5-dimethyltricyclo[9.4.0.0<3,8>]pentadeca-1(15),3(8),11(12),13-tetraen-7-one is C21H21N3O3.
What is the molecular weight of 2,10,12-triaza-9-benzo[d]1,3-dioxolan-5-yl-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-benzo[d]1,3-dioxolan-5-yl-5,5-dimethyltricyclo[9.4.0.0<3,8>]pentadeca-1(15),3(8),11(12),13-tetraen-7-one is 363.16 g/mol.
Where can I buy 2,10,12-triaza-9-benzo[d]1,3-dioxolan-5-yl-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-benzo[d]1,3-dioxolan-5-yl-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-benzo[d]1,3-dioxolan-5-yl-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-benzo[d]1,3-dioxolan-5-yl-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.