RefChem:1086930
TL;DR: RefChem:1086930 (CAS 119034-07-0) is a chemical compound with molecular formula C21H30N4O2 and molecular weight 370.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(E)-(1-methylpyrrol-2-yl)methylideneamino]-3-(4-octoxyphenyl)urea
Also Known As: Semicarbazide, 4-(p-octyloxyphenyl)-1-((1-methyl-2-pyrrolyl)methylene)-, Hydrazinecarboxamide, 2-((1-methyl-1H-pyrrol-2-yl)methylene)-N-(4-(octyloxy)phenyl)-, 1H-Pyrrole-2-carboxaldehyde, 1-methyl-, 4-(p-octyloxyphenyl)semicarbazone, Hydrazinecarboxamide, 2-((1-methyl-1H-pyrrol-2-yl)methylene)-N-(4-(octyloxy)phenyl)- (9CI), RefChem:1086930
| Molecular Formula | C21H30N4O2 |
|---|---|
| Molecular Weight | 370.24 g/mol |
| LogP | 4.92 |
| Topological Polar Surface Area | 67.65 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 11 |
| Exact Mass | 370.23688 |
| Heavy Atoms | 27 |
| Complexity | 707.2266 |
Chemical Identifiers
| CAS Number | 119034-07-0 |
|---|---|
| SMILES | CCCCCCCCOC1=CC=C(C=C1)NC(=O)N/N=C/C2=CC=CN2C |
Product Overview
RefChem:1086930 (CAS 119034-07-0), with molecular formula C21H30N4O2 and molecular weight 370.24 g/mol. IUPAC: 1-[(E)-(1-methylpyrrol-2-yl)methylideneamino]-3-(4-octoxyphenyl)urea.
Chemical Property Profile of RefChem:1086930
Property Insights of RefChem:1086930
The XLogP value of 4.92 indicates that RefChem:1086930 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.65 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1086930. Following Lipinski's Rule of Five, RefChem:1086930 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 RefChem:1086930?
The CAS number of RefChem:1086930 is 119034-07-0.
What is the molecular formula of RefChem:1086930?
The molecular formula of RefChem:1086930 is C21H30N4O2.
What is the molecular weight of RefChem:1086930?
The molecular weight of RefChem:1086930 is 370.24 g/mol.
Where can I buy RefChem:1086930?
You can request a quote for RefChem:1086930 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1086930?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1086930 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.