1-(4-Nitrophenyl)-3-octadeca-9,12-dienylurea
TL;DR: 1-(4-Nitrophenyl)-3-octadeca-9,12-dienylurea (CAS 6964-86-9) is a chemical compound with molecular formula C25H39N3O3 and molecular weight 429.30 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-nitrophenyl)-3-octadeca-9,12-dienylurea
Also Known As: 1-(4-nitrophenyl)-3-octadeca-9,12-dienylurea, 1-(4-nitrophenyl)-3-octadeca-9,12-dien-1-ylurea, 1-(4-nitrophenyl)-3-[(9E,12Z)-octadeca-9,12-dienyl]urea
| Molecular Formula | C25H39N3O3 |
|---|---|
| Molecular Weight | 429.30 g/mol |
| LogP | 8.0 |
| Topological Polar Surface Area | 87.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 16 |
| Exact Mass | 429.29913 |
| Heavy Atoms | 31 |
| Complexity | 521.0 |
Chemical Identifiers
| CAS Number | 6964-86-9 |
|---|---|
| SMILES | CCCCCC=CCC=CCCCCCCCCNC(=O)NC1=CC=C(C=C1)[N+](=O)[O-] |
| InChIKey | HFWGBPPQJSGWJH-UHFFFAOYSA-N |
Product Overview
1-(4-Nitrophenyl)-3-octadeca-9,12-dienylurea (CAS 6964-86-9), with molecular formula C25H39N3O3 and molecular weight 429.30 g/mol. IUPAC: 1-(4-nitrophenyl)-3-octadeca-9,12-dienylurea.
Chemical Property Profile of 1-(4-Nitrophenyl)-3-octadeca-9,12-dienylurea
Property Insights of 1-(4-Nitrophenyl)-3-octadeca-9,12-dienylurea
The XLogP value of 8.0 indicates that 1-(4-Nitrophenyl)-3-octadeca-9,12-dienylurea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 87.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(4-Nitrophenyl)-3-octadeca-9,12-dienylurea. Following Lipinski's Rule of Five, 1-(4-Nitrophenyl)-3-octadeca-9,12-dienylurea has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-(4-Nitrophenyl)-3-octadeca-9,12-dienylurea?
The CAS number of 1-(4-Nitrophenyl)-3-octadeca-9,12-dienylurea is 6964-86-9.
What is the molecular formula of 1-(4-Nitrophenyl)-3-octadeca-9,12-dienylurea?
The molecular formula of 1-(4-Nitrophenyl)-3-octadeca-9,12-dienylurea is C25H39N3O3.
What is the molecular weight of 1-(4-Nitrophenyl)-3-octadeca-9,12-dienylurea?
The molecular weight of 1-(4-Nitrophenyl)-3-octadeca-9,12-dienylurea is 429.30 g/mol.
Where can I buy 1-(4-Nitrophenyl)-3-octadeca-9,12-dienylurea?
You can request a quote for 1-(4-Nitrophenyl)-3-octadeca-9,12-dienylurea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Nitrophenyl)-3-octadeca-9,12-dienylurea?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Nitrophenyl)-3-octadeca-9,12-dienylurea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.