5-Acetyl-7-amino-4-methyl-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one
TL;DR: 5-Acetyl-7-amino-4-methyl-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one (CAS 201983-47-3) is a chemical compound with molecular formula C12H15N3O2 and molecular weight 233.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-acetyl-7-amino-4-methyl-3,4-dihydro-1H-1,5-benzodiazepin-2-one
Also Known As: 5-Acetyl-7-amino-4-methyl-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one, 5-acetyl-7-amino-4-methyl-3,4-dihydro-1H-1,5-benzodiazepin-2-one, 1H-Benzo[b]1,4-diazepin-2(3H)-one, 4,5-dihydro-5-acetyl-7-amino-4-methyl-, 2H-1,5-BENZODIAZEPIN-2-ONE, 5-ACETYL-7-AMINO-1,3,4,5-TETRAHYDRO-4-METHYL-, 5-Acetyl-7-amino-4-methyl-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one #
| Molecular Formula | C12H15N3O2 |
|---|---|
| Molecular Weight | 233.12 g/mol |
| LogP | -0.1 |
| Topological Polar Surface Area | 75.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 233.11642 |
| Heavy Atoms | 17 |
| Complexity | 332.0 |
Chemical Identifiers
| CAS Number | 201983-47-3 |
|---|---|
| SMILES | CC1CC(=O)NC2=C(N1C(=O)C)C=C(C=C2)N |
| InChIKey | RLMZHTXDKGQXKY-UHFFFAOYSA-N |
Product Overview
5-Acetyl-7-amino-4-methyl-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one (CAS 201983-47-3), with molecular formula C12H15N3O2 and molecular weight 233.12 g/mol. IUPAC: 5-acetyl-7-amino-4-methyl-3,4-dihydro-1H-1,5-benzodiazepin-2-one.
Chemical Property Profile of 5-Acetyl-7-amino-4-methyl-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one
Property Insights of 5-Acetyl-7-amino-4-methyl-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one
The XLogP value of -0.1 indicates that 5-Acetyl-7-amino-4-methyl-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 75.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Acetyl-7-amino-4-methyl-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one. Following Lipinski's Rule of Five, 5-Acetyl-7-amino-4-methyl-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one has 2 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 5-Acetyl-7-amino-4-methyl-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one?
The CAS number of 5-Acetyl-7-amino-4-methyl-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one is 201983-47-3.
What is the molecular formula of 5-Acetyl-7-amino-4-methyl-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one?
The molecular formula of 5-Acetyl-7-amino-4-methyl-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one is C12H15N3O2.
What is the molecular weight of 5-Acetyl-7-amino-4-methyl-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one?
The molecular weight of 5-Acetyl-7-amino-4-methyl-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one is 233.12 g/mol.
Where can I buy 5-Acetyl-7-amino-4-methyl-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one?
You can request a quote for 5-Acetyl-7-amino-4-methyl-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Acetyl-7-amino-4-methyl-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one?
Yes, KEHONG BIO provides custom synthesis services for 5-Acetyl-7-amino-4-methyl-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.