UP 614-04
TL;DR: UP 614-04 (CAS 89740-12-5) is a chemical compound with molecular formula C13H18ClN3O2 and molecular weight 283.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methyl-3-(morpholin-2-ylmethyl)benzimidazol-2-one;hydrochloride
Also Known As: UP 614-04, UP-614-04, 2-(1-Methyl-2-oxo-2,3-dihydrobenzimidazol-3-ylmethyl)morpholine monohydrochloride, 2H-Benzimidazol-2-one, 1,3-dihydro-1-methyl-3-(2-morpholinylmethyl)-, monohydrochloride, 1,3-Dihydro-1-methyl-3-(2-morpholinylmethyl)-2H-benzimidazol-2-one monohydrochloride
| Molecular Formula | C13H18ClN3O2 |
|---|---|
| Molecular Weight | 283.11 g/mol |
| LogP | 0.7502 |
| Topological Polar Surface Area | 44.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 283.10876 |
| Heavy Atoms | 19 |
| Complexity | 323.0 |
Chemical Identifiers
| CAS Number | 89740-12-5 |
|---|---|
| SMILES | CN1C2=CC=CC=C2N(C1=O)CC3CNCCO3.Cl |
| InChIKey | QCMQLVDPKSUFDA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
UP 614-04 (CAS 89740-12-5), with molecular formula C13H18ClN3O2 and molecular weight 283.11 g/mol. IUPAC: 1-methyl-3-(morpholin-2-ylmethyl)benzimidazol-2-one;hydrochloride.
Chemical Property Profile of UP 614-04
Property Insights of UP 614-04
The XLogP value of 0.7502 suggests moderate lipophilicity, balancing water solubility and membrane permeability for UP 614-04. With a topological polar surface area (TPSA) of 44.8 Ų, UP 614-04 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, UP 614-04 has 2 hydrogen bond donor(s) and 3 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 UP 614-04?
The CAS number of UP 614-04 is 89740-12-5.
What is the molecular formula of UP 614-04?
The molecular formula of UP 614-04 is C13H18ClN3O2.
What is the molecular weight of UP 614-04?
The molecular weight of UP 614-04 is 283.11 g/mol.
Where can I buy UP 614-04?
You can request a quote for UP 614-04 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UP 614-04?
Yes, KEHONG BIO provides custom synthesis services for UP 614-04 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.