Xilobam
TL;DR: Xilobam (CAS 50528-97-7) is a chemical compound with molecular formula C14H19N3O and molecular weight 245.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2,6-dimethylphenyl)-3-(1-methylpyrrolidin-2-ylidene)urea
Also Known As: XILOBAM, Xilobamum, Xilobam [USAN:INN], Xilobamum [INN-Latin], McN 3113
| Molecular Formula | C14H19N3O |
|---|---|
| Molecular Weight | 245.15 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 44.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 245.15282 |
| Heavy Atoms | 18 |
| Complexity | 330.0 |
Chemical Identifiers
| CAS Number | 50528-97-7 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)C)NC(=O)N=C2CCCN2C |
| InChIKey | PAXRPWSXCPTPCA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Xilobam (CAS 50528-97-7), with molecular formula C14H19N3O and molecular weight 245.15 g/mol. IUPAC: 1-(2,6-dimethylphenyl)-3-(1-methylpyrrolidin-2-ylidene)urea.
Chemical Property Profile of Xilobam
Property Insights of Xilobam
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Xilobam. With a topological polar surface area (TPSA) of 44.7 Ų, Xilobam exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Xilobam has 1 hydrogen bond donor(s) and 1 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 Xilobam?
The CAS number of Xilobam is 50528-97-7.
What is the molecular formula of Xilobam?
The molecular formula of Xilobam is C14H19N3O.
What is the molecular weight of Xilobam?
The molecular weight of Xilobam is 245.15 g/mol.
Where can I buy Xilobam?
You can request a quote for Xilobam directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Xilobam?
Yes, KEHONG BIO provides custom synthesis services for Xilobam and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.