5-Chloro-1,3-dihydro-1-(4-piperidinyl)-2H-benzimidazol-2-one
TL;DR: 5-Chloro-1,3-dihydro-1-(4-piperidinyl)-2H-benzimidazol-2-one (CAS 53786-28-0) is a chemical compound with molecular formula C12H14ClN3O and molecular weight 251.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-chloro-3-piperidin-4-yl-1H-benzimidazol-2-one
Also Known As: 5-Chloro-1-(4-piperidyl)-2-benzimidazolinone, DoMperidone EP IMpurity A, 5-Chloro-1-(piperidin-4-yl)-1H-benzo[d]imidazol-2(3H)-one, DOMPERIDONE IMPURITY A, DOMPERIDONE_met020
| Molecular Formula | C12H14ClN3O |
|---|---|
| Molecular Weight | 251.08 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 44.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 251.08253 |
| Heavy Atoms | 17 |
| Complexity | 306.0 |
Chemical Identifiers
| CAS Number | 53786-28-0 |
|---|---|
| SMILES | C1CNCCC1N2C3=C(C=C(C=C3)Cl)NC2=O |
| InChIKey | DOAYWDKFDPSTSV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-Chloro-1,3-dihydro-1-(4-piperidinyl)-2H-benzimidazol-2-one (CAS 53786-28-0), with molecular formula C12H14ClN3O and molecular weight 251.08 g/mol. IUPAC: 6-chloro-3-piperidin-4-yl-1H-benzimidazol-2-one.
Chemical Property Profile of 5-Chloro-1,3-dihydro-1-(4-piperidinyl)-2H-benzimidazol-2-one
Property Insights of 5-Chloro-1,3-dihydro-1-(4-piperidinyl)-2H-benzimidazol-2-one
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Chloro-1,3-dihydro-1-(4-piperidinyl)-2H-benzimidazol-2-one. With a topological polar surface area (TPSA) of 44.4 Ų, 5-Chloro-1,3-dihydro-1-(4-piperidinyl)-2H-benzimidazol-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Chloro-1,3-dihydro-1-(4-piperidinyl)-2H-benzimidazol-2-one 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 5-Chloro-1,3-dihydro-1-(4-piperidinyl)-2H-benzimidazol-2-one?
The CAS number of 5-Chloro-1,3-dihydro-1-(4-piperidinyl)-2H-benzimidazol-2-one is 53786-28-0.
What is the molecular formula of 5-Chloro-1,3-dihydro-1-(4-piperidinyl)-2H-benzimidazol-2-one?
The molecular formula of 5-Chloro-1,3-dihydro-1-(4-piperidinyl)-2H-benzimidazol-2-one is C12H14ClN3O.
What is the molecular weight of 5-Chloro-1,3-dihydro-1-(4-piperidinyl)-2H-benzimidazol-2-one?
The molecular weight of 5-Chloro-1,3-dihydro-1-(4-piperidinyl)-2H-benzimidazol-2-one is 251.08 g/mol.
Where can I buy 5-Chloro-1,3-dihydro-1-(4-piperidinyl)-2H-benzimidazol-2-one?
You can request a quote for 5-Chloro-1,3-dihydro-1-(4-piperidinyl)-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 5-Chloro-1,3-dihydro-1-(4-piperidinyl)-2H-benzimidazol-2-one?
Yes, KEHONG BIO provides custom synthesis services for 5-Chloro-1,3-dihydro-1-(4-piperidinyl)-2H-benzimidazol-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.