UR 12633
TL;DR: UR 12633 (CAS 179912-83-5) is a chemical compound with molecular formula C27H27N3O and molecular weight 409.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[1-(3,3-diphenylpropanoyl)piperidin-4-yl]-2-pyridin-3-ylacetonitrile
Also Known As: 1-(1-Oxo-3,3-diphenylpropyl)-alpha-3-pyridinyl-4-piperidineacetonitrile, 2-[1-(3,3-diphenylpropanoyl)piperidin-4-yl]-2-pyridin-3-ylacetonitrile, 4-Piperidineacetonitrile, 1-(1-oxo-3,3-diphenylpropyl)-alpha-3-pyridinyl-, 1-(3,3-Diphenylpropionyl)-4-(3-pyridylcyanomethyl)piperidine, 2-[1-(3,3-diphenylpropanoyl)piperidin-4-yl]-2-pyridin-3-ylac
| Molecular Formula | C27H27N3O |
|---|---|
| Molecular Weight | 409.22 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 57.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 409.21542 |
| Heavy Atoms | 31 |
| Complexity | 587.0 |
Chemical Identifiers
| CAS Number | 179912-83-5 |
|---|---|
| SMILES | C1CN(CCC1C(C#N)C2=CN=CC=C2)C(=O)CC(C3=CC=CC=C3)C4=CC=CC=C4 |
| InChIKey | BGZWWLNNRCYROI-UHFFFAOYSA-N |
Product Overview
UR 12633 (CAS 179912-83-5), with molecular formula C27H27N3O and molecular weight 409.22 g/mol. IUPAC: 2-[1-(3,3-diphenylpropanoyl)piperidin-4-yl]-2-pyridin-3-ylacetonitrile.
Chemical Property Profile of UR 12633
Property Insights of UR 12633
The XLogP value of 4.1 indicates that UR 12633 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.0 Ų, UR 12633 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, UR 12633 has 0 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 UR 12633?
The CAS number of UR 12633 is 179912-83-5.
What is the molecular formula of UR 12633?
The molecular formula of UR 12633 is C27H27N3O.
What is the molecular weight of UR 12633?
The molecular weight of UR 12633 is 409.22 g/mol.
Where can I buy UR 12633?
You can request a quote for UR 12633 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UR 12633?
Yes, KEHONG BIO provides custom synthesis services for UR 12633 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.