DivK1c_005090
TL;DR: DivK1c_005090 (CAS 82408-02-4) is a chemical compound with molecular formula C22H24N2O2 and molecular weight 348.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(4-methoxyphenyl)-9,9-dimethyl-6,8,10,11-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one
Also Known As: DivK1c_005090, CDS1_004050, 11-(4-methoxyphenyl)-3,3-dimethyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one, BAS 01095416, BIM-0017595.P001
| Molecular Formula | C22H24N2O2 |
|---|---|
| Molecular Weight | 348.18 g/mol |
| LogP | 4.9171 |
| Topological Polar Surface Area | 50.36 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 348.18378 |
| Heavy Atoms | 26 |
| Complexity | 881.2702 |
Chemical Identifiers
| CAS Number | 82408-02-4 |
|---|---|
| SMILES | CC1(CC2=C(C(NC3=CC=CC=C3N2)C4=CC=C(C=C4)OC)C(=O)C1)C |
Product Overview
DivK1c_005090 (CAS 82408-02-4), with molecular formula C22H24N2O2 and molecular weight 348.18 g/mol. IUPAC: 6-(4-methoxyphenyl)-9,9-dimethyl-6,8,10,11-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one.
Chemical Property Profile of DivK1c_005090
Property Insights of DivK1c_005090
The XLogP value of 4.9171 indicates that DivK1c_005090 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.36 Ų, DivK1c_005090 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, DivK1c_005090 has 2 hydrogen bond donor(s) and 4 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 DivK1c_005090?
The CAS number of DivK1c_005090 is 82408-02-4.
What is the molecular formula of DivK1c_005090?
The molecular formula of DivK1c_005090 is C22H24N2O2.
What is the molecular weight of DivK1c_005090?
The molecular weight of DivK1c_005090 is 348.18 g/mol.
Where can I buy DivK1c_005090?
You can request a quote for DivK1c_005090 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for DivK1c_005090?
Yes, KEHONG BIO provides custom synthesis services for DivK1c_005090 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.