2H-1,5-Benzodiazepin-2-one, 1,3-dihydro-4-(dimethylamino)-
TL;DR: 2H-1,5-Benzodiazepin-2-one, 1,3-dihydro-4-(dimethylamino)- (CAS 62537-60-4) is a chemical compound with molecular formula C11H13N3O and molecular weight 203.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(dimethylamino)-1,3-dihydro-1,5-benzodiazepin-2-one
Also Known As: K 9874, 4-(Dimethylamino)-1,3-dihydro-2H-1,5-benzodiazepin-2-one, 2H-1,5-Benzodiazepin-2-one, 1,3-dihydro-4-(dimethylamino)-, 4-(dimethylamino)-1,3-dihydro-1,5-benzodiazepin-2-one, 5-25-15-00091 (Beilstein Handbook Reference)
| Molecular Formula | C11H13N3O |
|---|---|
| Molecular Weight | 203.11 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 44.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 203.10587 |
| Heavy Atoms | 15 |
| Complexity | 286.0 |
Chemical Identifiers
| CAS Number | 62537-60-4 |
|---|---|
| SMILES | CN(C)C1=NC2=CC=CC=C2NC(=O)C1 |
| InChIKey | SZOFIRPATPUCFF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2H-1,5-Benzodiazepin-2-one, 1,3-dihydro-4-(dimethylamino)- (CAS 62537-60-4), with molecular formula C11H13N3O and molecular weight 203.11 g/mol. IUPAC: 4-(dimethylamino)-1,3-dihydro-1,5-benzodiazepin-2-one.
Chemical Property Profile of 2H-1,5-Benzodiazepin-2-one, 1,3-dihydro-4-(dimethylamino)-
Property Insights of 2H-1,5-Benzodiazepin-2-one, 1,3-dihydro-4-(dimethylamino)-
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2H-1,5-Benzodiazepin-2-one, 1,3-dihydro-4-(dimethylamino)-. With a topological polar surface area (TPSA) of 44.7 Ų, 2H-1,5-Benzodiazepin-2-one, 1,3-dihydro-4-(dimethylamino)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2H-1,5-Benzodiazepin-2-one, 1,3-dihydro-4-(dimethylamino)- has 1 hydrogen bond donor(s) and 2 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 2H-1,5-Benzodiazepin-2-one, 1,3-dihydro-4-(dimethylamino)-?
The CAS number of 2H-1,5-Benzodiazepin-2-one, 1,3-dihydro-4-(dimethylamino)- is 62537-60-4.
What is the molecular formula of 2H-1,5-Benzodiazepin-2-one, 1,3-dihydro-4-(dimethylamino)-?
The molecular formula of 2H-1,5-Benzodiazepin-2-one, 1,3-dihydro-4-(dimethylamino)- is C11H13N3O.
What is the molecular weight of 2H-1,5-Benzodiazepin-2-one, 1,3-dihydro-4-(dimethylamino)-?
The molecular weight of 2H-1,5-Benzodiazepin-2-one, 1,3-dihydro-4-(dimethylamino)- is 203.11 g/mol.
Where can I buy 2H-1,5-Benzodiazepin-2-one, 1,3-dihydro-4-(dimethylamino)-?
You can request a quote for 2H-1,5-Benzodiazepin-2-one, 1,3-dihydro-4-(dimethylamino)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2H-1,5-Benzodiazepin-2-one, 1,3-dihydro-4-(dimethylamino)-?
Yes, KEHONG BIO provides custom synthesis services for 2H-1,5-Benzodiazepin-2-one, 1,3-dihydro-4-(dimethylamino)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.