N-((3,4-Dimethoxyphenyl)methyl)-N'-(4-fluorophenyl)-N-(phenylmethyl)thiourea
TL;DR: N-((3,4-Dimethoxyphenyl)methyl)-N'-(4-fluorophenyl)-N-(phenylmethyl)thiourea (CAS 309734-89-2) is a chemical compound with molecular formula C23H23FN2O2S and molecular weight 410.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-benzyl-1-[(3,4-dimethoxyphenyl)methyl]-3-(4-fluorophenyl)thiourea
Also Known As: 1-benzyl-1-[(3,4-dimethoxyphenyl)methyl]-3-(4-fluorophenyl)thiourea, A2252/0094859, N-Benzyl-N-[(3,4-dimethoxyphenyl)methyl]-N'-(4-fluorophenyl)thiourea, N-((3,4-Dimethoxyphenyl)methyl)-N'-(4-fluorophenyl)-N-(phenylmethyl)thiourea, N-[(3,4-Dimethoxyphenyl)methyl]-N'-(4-fluorophenyl)-N-(phenylmethyl)thiourea
| Molecular Formula | C23H23FN2O2S |
|---|---|
| Molecular Weight | 410.15 g/mol |
| LogP | 5.2421 |
| Topological Polar Surface Area | 33.73 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 410.14642 |
| Heavy Atoms | 29 |
| Complexity | 948.8515 |
Chemical Identifiers
| CAS Number | 309734-89-2 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)CN(CC2=CC=CC=C2)C(=S)NC3=CC=C(C=C3)F)OC |
Product Overview
N-((3,4-Dimethoxyphenyl)methyl)-N'-(4-fluorophenyl)-N-(phenylmethyl)thiourea (CAS 309734-89-2), with molecular formula C23H23FN2O2S and molecular weight 410.15 g/mol. IUPAC: 1-benzyl-1-[(3,4-dimethoxyphenyl)methyl]-3-(4-fluorophenyl)thiourea.
Chemical Property Profile of N-((3,4-Dimethoxyphenyl)methyl)-N'-(4-fluorophenyl)-N-(phenylmethyl)thiourea
Property Insights of N-((3,4-Dimethoxyphenyl)methyl)-N'-(4-fluorophenyl)-N-(phenylmethyl)thiourea
The XLogP value of 5.2421 indicates that N-((3,4-Dimethoxyphenyl)methyl)-N'-(4-fluorophenyl)-N-(phenylmethyl)thiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 33.73 Ų, N-((3,4-Dimethoxyphenyl)methyl)-N'-(4-fluorophenyl)-N-(phenylmethyl)thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-((3,4-Dimethoxyphenyl)methyl)-N'-(4-fluorophenyl)-N-(phenylmethyl)thiourea has 1 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 N-((3,4-Dimethoxyphenyl)methyl)-N'-(4-fluorophenyl)-N-(phenylmethyl)thiourea?
The CAS number of N-((3,4-Dimethoxyphenyl)methyl)-N'-(4-fluorophenyl)-N-(phenylmethyl)thiourea is 309734-89-2.
What is the molecular formula of N-((3,4-Dimethoxyphenyl)methyl)-N'-(4-fluorophenyl)-N-(phenylmethyl)thiourea?
The molecular formula of N-((3,4-Dimethoxyphenyl)methyl)-N'-(4-fluorophenyl)-N-(phenylmethyl)thiourea is C23H23FN2O2S.
What is the molecular weight of N-((3,4-Dimethoxyphenyl)methyl)-N'-(4-fluorophenyl)-N-(phenylmethyl)thiourea?
The molecular weight of N-((3,4-Dimethoxyphenyl)methyl)-N'-(4-fluorophenyl)-N-(phenylmethyl)thiourea is 410.15 g/mol.
Where can I buy N-((3,4-Dimethoxyphenyl)methyl)-N'-(4-fluorophenyl)-N-(phenylmethyl)thiourea?
You can request a quote for N-((3,4-Dimethoxyphenyl)methyl)-N'-(4-fluorophenyl)-N-(phenylmethyl)thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-((3,4-Dimethoxyphenyl)methyl)-N'-(4-fluorophenyl)-N-(phenylmethyl)thiourea?
Yes, KEHONG BIO provides custom synthesis services for N-((3,4-Dimethoxyphenyl)methyl)-N'-(4-fluorophenyl)-N-(phenylmethyl)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.