3H-benzimidazol-5-yl(3,4-dihydro-1H-isoquinolin-2-yl)methanone
TL;DR: 3H-benzimidazol-5-yl(3,4-dihydro-1H-isoquinolin-2-yl)methanone (CAS 785809-33-8) is a chemical compound with molecular formula C17H15N3O and molecular weight 277.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3H-benzimidazol-5-yl(3,4-dihydro-1H-isoquinolin-2-yl)methanone
Also Known As: 3H-benzimidazol-5-yl(3,4-dihydro-1H-isoquinolin-2-yl)methanone, (1H-1,3-Benzimidazol-6-yl)(3,4-dihydroisoquinolin-2(1H)-yl)methanone, (1H-Benzo[d]imidazol-5-yl)(3,4-dihydroisoquinolin-2(1H)-yl)methanone, Isoquinoline, 2-(1H-benzimidazol-5-ylcarbonyl)-1,2,3,4-tetrahydro-, RefChem:283094
| Molecular Formula | C17H15N3O |
|---|---|
| Molecular Weight | 277.12 g/mol |
| LogP | 2.7614 |
| Topological Polar Surface Area | 48.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 277.12152 |
| Heavy Atoms | 21 |
| Complexity | 821.5231 |
Chemical Identifiers
| CAS Number | 785809-33-8 |
|---|---|
| SMILES | C1CN(CC2=CC=CC=C21)C(=O)C3=CC4=C(C=C3)N=CN4 |
Product Overview
3H-benzimidazol-5-yl(3,4-dihydro-1H-isoquinolin-2-yl)methanone (CAS 785809-33-8), with molecular formula C17H15N3O and molecular weight 277.12 g/mol. IUPAC: 3H-benzimidazol-5-yl(3,4-dihydro-1H-isoquinolin-2-yl)methanone.
Chemical Property Profile of 3H-benzimidazol-5-yl(3,4-dihydro-1H-isoquinolin-2-yl)methanone
Property Insights of 3H-benzimidazol-5-yl(3,4-dihydro-1H-isoquinolin-2-yl)methanone
The XLogP value of 2.7614 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3H-benzimidazol-5-yl(3,4-dihydro-1H-isoquinolin-2-yl)methanone. With a topological polar surface area (TPSA) of 48.99 Ų, 3H-benzimidazol-5-yl(3,4-dihydro-1H-isoquinolin-2-yl)methanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3H-benzimidazol-5-yl(3,4-dihydro-1H-isoquinolin-2-yl)methanone 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 3H-benzimidazol-5-yl(3,4-dihydro-1H-isoquinolin-2-yl)methanone?
The CAS number of 3H-benzimidazol-5-yl(3,4-dihydro-1H-isoquinolin-2-yl)methanone is 785809-33-8.
What is the molecular formula of 3H-benzimidazol-5-yl(3,4-dihydro-1H-isoquinolin-2-yl)methanone?
The molecular formula of 3H-benzimidazol-5-yl(3,4-dihydro-1H-isoquinolin-2-yl)methanone is C17H15N3O.
What is the molecular weight of 3H-benzimidazol-5-yl(3,4-dihydro-1H-isoquinolin-2-yl)methanone?
The molecular weight of 3H-benzimidazol-5-yl(3,4-dihydro-1H-isoquinolin-2-yl)methanone is 277.12 g/mol.
Where can I buy 3H-benzimidazol-5-yl(3,4-dihydro-1H-isoquinolin-2-yl)methanone?
You can request a quote for 3H-benzimidazol-5-yl(3,4-dihydro-1H-isoquinolin-2-yl)methanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3H-benzimidazol-5-yl(3,4-dihydro-1H-isoquinolin-2-yl)methanone?
Yes, KEHONG BIO provides custom synthesis services for 3H-benzimidazol-5-yl(3,4-dihydro-1H-isoquinolin-2-yl)methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.