6H-Pyrido(2,3-b)(1,4)benzodiazepin-6-one, 5,11-dihydro-11-((4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl)acetyl)-5-methyl-
TL;DR: 6H-Pyrido(2,3-b)(1,4)benzodiazepin-6-one, 5,11-dihydro-11-((4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl)acetyl)-5-methyl- (CAS 69628-31-5) is a chemical compound with molecular formula C27H27N5O4 and molecular weight 485.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
11-[2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]acetyl]-5-methylpyrido[2,3-b][1,4]benzodiazepin-6-one
Also Known As: 6H-Pyrido(2,3-b)(1,4)benzodiazepin-6-one, 5,11-dihydro-11-((4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl)acetyl)-5-methyl-, 11-({4-[(2H-1,3-Benzodioxol-5-yl)methyl]piperazin-1-yl}acetyl)-5-methyl-5,11-dihydro-6H-pyrido[2,3-b][1,4]benzodiazepin-6-one, 11-[2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]acetyl]-5-methylpyrido[2,3-b][1,4]benzodiazepin-6-one, 5,11-Dihydro-5-methyl-11-{[4-(3,4methylenedioxy-benzyl)-1-piperazinyl]acetyl}-6H-pyrido[2,3-b][1,4]benzodiazepin-6-one, RefChem:309710
| Molecular Formula | C27H27N5O4 |
|---|---|
| Molecular Weight | 485.21 g/mol |
| LogP | 2.8828 |
| Topological Polar Surface Area | 78.45 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 485.2063 |
| Heavy Atoms | 36 |
| Complexity | 1321.0211 |
Chemical Identifiers
| CAS Number | 69628-31-5 |
|---|---|
| SMILES | CN1C2=C(N=CC=C2)N(C3=CC=CC=C3C1=O)C(=O)CN4CCN(CC4)CC5=CC6=C(C=C5)OCO6 |
Product Overview
6H-Pyrido(2,3-b)(1,4)benzodiazepin-6-one, 5,11-dihydro-11-((4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl)acetyl)-5-methyl- (CAS 69628-31-5), with molecular formula C27H27N5O4 and molecular weight 485.21 g/mol. IUPAC: 11-[2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]acetyl]-5-methylpyrido[2,3-b][1,4]benzodiazepin-6-one.
Chemical Property Profile of 6H-Pyrido(2,3-b)(1,4)benzodiazepin-6-one, 5,11-dihydro-11-((4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl)acetyl)-5-methyl-
Property Insights of 6H-Pyrido(2,3-b)(1,4)benzodiazepin-6-one, 5,11-dihydro-11-((4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl)acetyl)-5-methyl-
The XLogP value of 2.8828 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6H-Pyrido(2,3-b)(1,4)benzodiazepin-6-one, 5,11-dihydro-11-((4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl)acetyl)-5-methyl-. The TPSA of 78.45 Ų falls within the moderate polarity range, balancing permeability and solubility for 6H-Pyrido(2,3-b)(1,4)benzodiazepin-6-one, 5,11-dihydro-11-((4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl)acetyl)-5-methyl-. Following Lipinski's Rule of Five, 6H-Pyrido(2,3-b)(1,4)benzodiazepin-6-one, 5,11-dihydro-11-((4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl)acetyl)-5-methyl- has 0 hydrogen bond donor(s) and 7 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 6H-Pyrido(2,3-b)(1,4)benzodiazepin-6-one, 5,11-dihydro-11-((4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl)acetyl)-5-methyl-?
The CAS number of 6H-Pyrido(2,3-b)(1,4)benzodiazepin-6-one, 5,11-dihydro-11-((4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl)acetyl)-5-methyl- is 69628-31-5.
What is the molecular formula of 6H-Pyrido(2,3-b)(1,4)benzodiazepin-6-one, 5,11-dihydro-11-((4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl)acetyl)-5-methyl-?
The molecular formula of 6H-Pyrido(2,3-b)(1,4)benzodiazepin-6-one, 5,11-dihydro-11-((4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl)acetyl)-5-methyl- is C27H27N5O4.
What is the molecular weight of 6H-Pyrido(2,3-b)(1,4)benzodiazepin-6-one, 5,11-dihydro-11-((4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl)acetyl)-5-methyl-?
The molecular weight of 6H-Pyrido(2,3-b)(1,4)benzodiazepin-6-one, 5,11-dihydro-11-((4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl)acetyl)-5-methyl- is 485.21 g/mol.
Where can I buy 6H-Pyrido(2,3-b)(1,4)benzodiazepin-6-one, 5,11-dihydro-11-((4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl)acetyl)-5-methyl-?
You can request a quote for 6H-Pyrido(2,3-b)(1,4)benzodiazepin-6-one, 5,11-dihydro-11-((4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl)acetyl)-5-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6H-Pyrido(2,3-b)(1,4)benzodiazepin-6-one, 5,11-dihydro-11-((4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl)acetyl)-5-methyl-?
Yes, KEHONG BIO provides custom synthesis services for 6H-Pyrido(2,3-b)(1,4)benzodiazepin-6-one, 5,11-dihydro-11-((4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl)acetyl)-5-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.