1-(3-phenoxypropyl)-1,3-dihydro-2H-benzimidazol-2-one
TL;DR: 1-(3-phenoxypropyl)-1,3-dihydro-2H-benzimidazol-2-one (CAS 537702-34-4) is a chemical compound with molecular formula C16H16N2O2 and molecular weight 268.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(3-phenoxypropyl)-1H-benzimidazol-2-one
Also Known As: 3-(3-phenoxypropyl)-1H-benzimidazol-2-one, BAS 05465906, 1-(3-phenoxypropyl)-1,3-dihydro-2H-benzimidazol-2-one, 1-(3-phenoxypropyl)-3-hydrobenzimidazol-2-one, 1-(3-Phenoxy-propyl)-1,3-dihydro-benzoimidazol-2-one
| Molecular Formula | C16H16N2O2 |
|---|---|
| Molecular Weight | 268.12 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 41.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 268.1212 |
| Heavy Atoms | 20 |
| Complexity | 328.0 |
Chemical Identifiers
| CAS Number | 537702-34-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)OCCCN2C3=CC=CC=C3NC2=O |
| InChIKey | KQWOOYFODBWMQK-UHFFFAOYSA-N |
Product Overview
1-(3-phenoxypropyl)-1,3-dihydro-2H-benzimidazol-2-one (CAS 537702-34-4), with molecular formula C16H16N2O2 and molecular weight 268.12 g/mol. IUPAC: 3-(3-phenoxypropyl)-1H-benzimidazol-2-one.
Chemical Property Profile of 1-(3-phenoxypropyl)-1,3-dihydro-2H-benzimidazol-2-one
Property Insights of 1-(3-phenoxypropyl)-1,3-dihydro-2H-benzimidazol-2-one
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(3-phenoxypropyl)-1,3-dihydro-2H-benzimidazol-2-one. With a topological polar surface area (TPSA) of 41.6 Ų, 1-(3-phenoxypropyl)-1,3-dihydro-2H-benzimidazol-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(3-phenoxypropyl)-1,3-dihydro-2H-benzimidazol-2-one 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 1-(3-phenoxypropyl)-1,3-dihydro-2H-benzimidazol-2-one?
The CAS number of 1-(3-phenoxypropyl)-1,3-dihydro-2H-benzimidazol-2-one is 537702-34-4.
What is the molecular formula of 1-(3-phenoxypropyl)-1,3-dihydro-2H-benzimidazol-2-one?
The molecular formula of 1-(3-phenoxypropyl)-1,3-dihydro-2H-benzimidazol-2-one is C16H16N2O2.
What is the molecular weight of 1-(3-phenoxypropyl)-1,3-dihydro-2H-benzimidazol-2-one?
The molecular weight of 1-(3-phenoxypropyl)-1,3-dihydro-2H-benzimidazol-2-one is 268.12 g/mol.
Where can I buy 1-(3-phenoxypropyl)-1,3-dihydro-2H-benzimidazol-2-one?
You can request a quote for 1-(3-phenoxypropyl)-1,3-dihydro-2H-benzimidazol-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3-phenoxypropyl)-1,3-dihydro-2H-benzimidazol-2-one?
Yes, KEHONG BIO provides custom synthesis services for 1-(3-phenoxypropyl)-1,3-dihydro-2H-benzimidazol-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.