1H-1,5-Benzodiazepine-2-carbonitrile, 7,7'-methylenebis(2,3,4,5-tetrahydro-4-phenyl)-
TL;DR: 1H-1,5-Benzodiazepine-2-carbonitrile, 7,7'-methylenebis(2,3,4,5-tetrahydro-4-phenyl)- (CAS 58536-14-4) is a chemical compound with molecular formula C33H30N6 and molecular weight 510.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-[(2-cyano-4-phenyl-2,3,4,5-tetrahydro-1H-1,5-benzodiazepin-7-yl)methyl]-4-phenyl-2,3,4,5-tetrahydro-1H-1,5-benzodiazepine-2-carbonitrile
Also Known As: 1H-1,5-Benzodiazepine-2-carbonitrile, 7,7'-methylenebis(2,3,4,5-tetrahydro-4-phenyl)-, 7,7'-Methylenebis(2,3,4,5-tetrahydro-4-phenyl)-1H-1,5-benzodiazepine-2-carbonitrile, 7,7'-Methylenebis(4-phenyl-2,3,4,5-tetrahydro-1H-1,5-benzodiazepine-2-carbonitrile), 7-[(2-cyano-4-phenyl-2,3,4,5-tetrahydro-1H-1,5-benzodiazepin-7-yl)methyl]-4-phenyl-2,3,4,5-tetrahydro-1H-1,5-benzodiazepine-2-carbonitrile, RefChem:1057751
| Molecular Formula | C33H30N6 |
|---|---|
| Molecular Weight | 510.25 g/mol |
| LogP | 6.99936 |
| Topological Polar Surface Area | 95.7 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 510.2532 |
| Heavy Atoms | 39 |
| Complexity | 1419.4604 |
Chemical Identifiers
| CAS Number | 58536-14-4 |
|---|---|
| SMILES | C1C(NC2=C(C=C(C=C2)CC3=CC4=C(C=C3)NC(CC(N4)C5=CC=CC=C5)C#N)NC1C6=CC=CC=C6)C#N |
Product Overview
1H-1,5-Benzodiazepine-2-carbonitrile, 7,7'-methylenebis(2,3,4,5-tetrahydro-4-phenyl)- (CAS 58536-14-4), with molecular formula C33H30N6 and molecular weight 510.25 g/mol. IUPAC: 7-[(2-cyano-4-phenyl-2,3,4,5-tetrahydro-1H-1,5-benzodiazepin-7-yl)methyl]-4-phenyl-2,3,4,5-tetrahydro-1H-1,5-benzodiazepine-2-carbonitrile.
Chemical Property Profile of 1H-1,5-Benzodiazepine-2-carbonitrile, 7,7'-methylenebis(2,3,4,5-tetrahydro-4-phenyl)-
Property Insights of 1H-1,5-Benzodiazepine-2-carbonitrile, 7,7'-methylenebis(2,3,4,5-tetrahydro-4-phenyl)-
The XLogP value of 6.99936 indicates that 1H-1,5-Benzodiazepine-2-carbonitrile, 7,7'-methylenebis(2,3,4,5-tetrahydro-4-phenyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 1H-1,5-Benzodiazepine-2-carbonitrile, 7,7'-methylenebis(2,3,4,5-tetrahydro-4-phenyl)-. Following Lipinski's Rule of Five, 1H-1,5-Benzodiazepine-2-carbonitrile, 7,7'-methylenebis(2,3,4,5-tetrahydro-4-phenyl)- has 4 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1H-1,5-Benzodiazepine-2-carbonitrile, 7,7'-methylenebis(2,3,4,5-tetrahydro-4-phenyl)-?
The CAS number of 1H-1,5-Benzodiazepine-2-carbonitrile, 7,7'-methylenebis(2,3,4,5-tetrahydro-4-phenyl)- is 58536-14-4.
What is the molecular formula of 1H-1,5-Benzodiazepine-2-carbonitrile, 7,7'-methylenebis(2,3,4,5-tetrahydro-4-phenyl)-?
The molecular formula of 1H-1,5-Benzodiazepine-2-carbonitrile, 7,7'-methylenebis(2,3,4,5-tetrahydro-4-phenyl)- is C33H30N6.
What is the molecular weight of 1H-1,5-Benzodiazepine-2-carbonitrile, 7,7'-methylenebis(2,3,4,5-tetrahydro-4-phenyl)-?
The molecular weight of 1H-1,5-Benzodiazepine-2-carbonitrile, 7,7'-methylenebis(2,3,4,5-tetrahydro-4-phenyl)- is 510.25 g/mol.
Where can I buy 1H-1,5-Benzodiazepine-2-carbonitrile, 7,7'-methylenebis(2,3,4,5-tetrahydro-4-phenyl)-?
You can request a quote for 1H-1,5-Benzodiazepine-2-carbonitrile, 7,7'-methylenebis(2,3,4,5-tetrahydro-4-phenyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-1,5-Benzodiazepine-2-carbonitrile, 7,7'-methylenebis(2,3,4,5-tetrahydro-4-phenyl)-?
Yes, KEHONG BIO provides custom synthesis services for 1H-1,5-Benzodiazepine-2-carbonitrile, 7,7'-methylenebis(2,3,4,5-tetrahydro-4-phenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.