N-(2,6-dimethylphenyl)-N'-(4-isopropoxybenzoyl)thiourea
TL;DR: N-(2,6-dimethylphenyl)-N'-(4-isopropoxybenzoyl)thiourea (CAS 428485-18-1) is a chemical compound with molecular formula C19H22N2O2S and molecular weight 342.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(2,6-dimethylphenyl)carbamothioyl]-4-propan-2-yloxybenzamide
Also Known As: N-(2,6-dimethylphenyl)-N'-(4-isopropoxybenzoyl)thiourea, AB00108764-01, N-[(2,6-dimethylphenyl)carbamothioyl]-4-propan-2-yloxybenzamide
| Molecular Formula | C19H22N2O2S |
|---|---|
| Molecular Weight | 342.14 g/mol |
| LogP | 4.21744 |
| Topological Polar Surface Area | 50.36 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 342.1402 |
| Heavy Atoms | 24 |
| Complexity | 719.28204 |
Chemical Identifiers
| CAS Number | 428485-18-1 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)C)NC(=S)NC(=O)C2=CC=C(C=C2)OC(C)C |
Product Overview
N-(2,6-dimethylphenyl)-N'-(4-isopropoxybenzoyl)thiourea (CAS 428485-18-1), with molecular formula C19H22N2O2S and molecular weight 342.14 g/mol. IUPAC: N-[(2,6-dimethylphenyl)carbamothioyl]-4-propan-2-yloxybenzamide.
Chemical Property Profile of N-(2,6-dimethylphenyl)-N'-(4-isopropoxybenzoyl)thiourea
Property Insights of N-(2,6-dimethylphenyl)-N'-(4-isopropoxybenzoyl)thiourea
The XLogP value of 4.21744 indicates that N-(2,6-dimethylphenyl)-N'-(4-isopropoxybenzoyl)thiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.36 Ų, N-(2,6-dimethylphenyl)-N'-(4-isopropoxybenzoyl)thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(2,6-dimethylphenyl)-N'-(4-isopropoxybenzoyl)thiourea 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 N-(2,6-dimethylphenyl)-N'-(4-isopropoxybenzoyl)thiourea?
The CAS number of N-(2,6-dimethylphenyl)-N'-(4-isopropoxybenzoyl)thiourea is 428485-18-1.
What is the molecular formula of N-(2,6-dimethylphenyl)-N'-(4-isopropoxybenzoyl)thiourea?
The molecular formula of N-(2,6-dimethylphenyl)-N'-(4-isopropoxybenzoyl)thiourea is C19H22N2O2S.
What is the molecular weight of N-(2,6-dimethylphenyl)-N'-(4-isopropoxybenzoyl)thiourea?
The molecular weight of N-(2,6-dimethylphenyl)-N'-(4-isopropoxybenzoyl)thiourea is 342.14 g/mol.
Where can I buy N-(2,6-dimethylphenyl)-N'-(4-isopropoxybenzoyl)thiourea?
You can request a quote for N-(2,6-dimethylphenyl)-N'-(4-isopropoxybenzoyl)thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2,6-dimethylphenyl)-N'-(4-isopropoxybenzoyl)thiourea?
Yes, KEHONG BIO provides custom synthesis services for N-(2,6-dimethylphenyl)-N'-(4-isopropoxybenzoyl)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.