N,N-diallyl-N'-(4-tert-butylbenzoyl)thiourea
TL;DR: N,N-diallyl-N'-(4-tert-butylbenzoyl)thiourea (CAS 791792-45-5) is a chemical compound with molecular formula C18H24N2OS and molecular weight 316.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[bis(prop-2-enyl)carbamothioyl]-4-tert-butylbenzamide
Also Known As: N,N-diallyl-N'-(4-tert-butylbenzoyl)thiourea, N,N-Diallyl-N/'-(4-tert-butylbenzoyl)thiourea, 4-tert-butyl-N-[(diallylamino)carbonothioyl]benzamide, AN-329/42607868, N-[bis(prop-2-enyl)carbamothioyl]-4-tert-butylbenzamide
| Molecular Formula | C18H24N2OS |
|---|---|
| Molecular Weight | 316.16 g/mol |
| LogP | 3.6728 |
| Topological Polar Surface Area | 32.34 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 316.16095 |
| Heavy Atoms | 22 |
| Complexity | 545.44507 |
Chemical Identifiers
| CAS Number | 791792-45-5 |
|---|---|
| SMILES | CC(C)(C)C1=CC=C(C=C1)C(=O)NC(=S)N(CC=C)CC=C |
Product Overview
N,N-diallyl-N'-(4-tert-butylbenzoyl)thiourea (CAS 791792-45-5), with molecular formula C18H24N2OS and molecular weight 316.16 g/mol. IUPAC: N-[bis(prop-2-enyl)carbamothioyl]-4-tert-butylbenzamide.
Chemical Property Profile of N,N-diallyl-N'-(4-tert-butylbenzoyl)thiourea
Property Insights of N,N-diallyl-N'-(4-tert-butylbenzoyl)thiourea
The XLogP value of 3.6728 indicates that N,N-diallyl-N'-(4-tert-butylbenzoyl)thiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.34 Ų, N,N-diallyl-N'-(4-tert-butylbenzoyl)thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N,N-diallyl-N'-(4-tert-butylbenzoyl)thiourea has 1 hydrogen bond donor(s) and 2 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 N,N-diallyl-N'-(4-tert-butylbenzoyl)thiourea?
The CAS number of N,N-diallyl-N'-(4-tert-butylbenzoyl)thiourea is 791792-45-5.
What is the molecular formula of N,N-diallyl-N'-(4-tert-butylbenzoyl)thiourea?
The molecular formula of N,N-diallyl-N'-(4-tert-butylbenzoyl)thiourea is C18H24N2OS.
What is the molecular weight of N,N-diallyl-N'-(4-tert-butylbenzoyl)thiourea?
The molecular weight of N,N-diallyl-N'-(4-tert-butylbenzoyl)thiourea is 316.16 g/mol.
Where can I buy N,N-diallyl-N'-(4-tert-butylbenzoyl)thiourea?
You can request a quote for N,N-diallyl-N'-(4-tert-butylbenzoyl)thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N-diallyl-N'-(4-tert-butylbenzoyl)thiourea?
Yes, KEHONG BIO provides custom synthesis services for N,N-diallyl-N'-(4-tert-butylbenzoyl)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.