![1H-Pyrido[2,3-b]-1,4-benzodiazepin-6-one, 2,3,4,4a,5,6-hexahydro- structure](/static/products/847/84772-31-6.png)
1H-Pyrido[2,3-b]-1,4-benzodiazepin-6-one, 2,3,4,4a,5,6-hexahydro-
TL;DR: 1H-Pyrido[2,3-b]-1,4-benzodiazepin-6-one, 2,3,4,4a,5,6-hexahydro- (CAS 84772-31-6) is a chemical compound with molecular formula C12H13N3O and molecular weight 215.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3,4,4a,5,11-hexahydropyrido[2,3-b][1,4]benzodiazepin-6-one
Also Known As: 2,3,4,4a,5,11-hexahydropyrido[2,3-b][1,4]benzodiazepin-6-one, 1,2,3,4,4a,5-Hexahydro-6H-pyrido[2,3-b][1,4]benzodiazepin-6-one, 1,2,3,4,4a,5-Hexahydro-6H-pyrido[2,3-b][1,4]benzodiazepin-6-one #, 1H-Pyrido[2,3-b]-1,4-benzodiazepin-6-one, 2,3,4,4a,5,6-hexahydro-, 2,3,4,4a,5,11-hexahydro-6H-pyrido[2,3-b][1,4]benzodiazepin-6-one
| Molecular Formula | C12H13N3O |
|---|---|
| Molecular Weight | 215.11 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 53.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 215.10587 |
| Heavy Atoms | 16 |
| Complexity | 326.0 |
Chemical Identifiers
| CAS Number | 84772-31-6 |
|---|---|
| SMILES | C1CC2C(=NC1)NC3=CC=CC=C3C(=O)N2 |
| InChIKey | WNMMDOLKWLYWLL-UHFFFAOYSA-N |
Product Overview
1H-Pyrido[2,3-b]-1,4-benzodiazepin-6-one, 2,3,4,4a,5,6-hexahydro- (CAS 84772-31-6), with molecular formula C12H13N3O and molecular weight 215.11 g/mol. IUPAC: 2,3,4,4a,5,11-hexahydropyrido[2,3-b][1,4]benzodiazepin-6-one.
Chemical Property Profile of 1H-Pyrido[2,3-b]-1,4-benzodiazepin-6-one, 2,3,4,4a,5,6-hexahydro-
Property Insights of 1H-Pyrido[2,3-b]-1,4-benzodiazepin-6-one, 2,3,4,4a,5,6-hexahydro-
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-Pyrido[2,3-b]-1,4-benzodiazepin-6-one, 2,3,4,4a,5,6-hexahydro-. With a topological polar surface area (TPSA) of 53.5 Ų, 1H-Pyrido[2,3-b]-1,4-benzodiazepin-6-one, 2,3,4,4a,5,6-hexahydro- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-Pyrido[2,3-b]-1,4-benzodiazepin-6-one, 2,3,4,4a,5,6-hexahydro- has 2 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 1H-Pyrido[2,3-b]-1,4-benzodiazepin-6-one, 2,3,4,4a,5,6-hexahydro-?
The CAS number of 1H-Pyrido[2,3-b]-1,4-benzodiazepin-6-one, 2,3,4,4a,5,6-hexahydro- is 84772-31-6.
What is the molecular formula of 1H-Pyrido[2,3-b]-1,4-benzodiazepin-6-one, 2,3,4,4a,5,6-hexahydro-?
The molecular formula of 1H-Pyrido[2,3-b]-1,4-benzodiazepin-6-one, 2,3,4,4a,5,6-hexahydro- is C12H13N3O.
What is the molecular weight of 1H-Pyrido[2,3-b]-1,4-benzodiazepin-6-one, 2,3,4,4a,5,6-hexahydro-?
The molecular weight of 1H-Pyrido[2,3-b]-1,4-benzodiazepin-6-one, 2,3,4,4a,5,6-hexahydro- is 215.11 g/mol.
Where can I buy 1H-Pyrido[2,3-b]-1,4-benzodiazepin-6-one, 2,3,4,4a,5,6-hexahydro-?
You can request a quote for 1H-Pyrido[2,3-b]-1,4-benzodiazepin-6-one, 2,3,4,4a,5,6-hexahydro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Pyrido[2,3-b]-1,4-benzodiazepin-6-one, 2,3,4,4a,5,6-hexahydro-?
Yes, KEHONG BIO provides custom synthesis services for 1H-Pyrido[2,3-b]-1,4-benzodiazepin-6-one, 2,3,4,4a,5,6-hexahydro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.