3-[2-(5-FLUORO-2-METHYL-1H-INDOL-3-YL)ETHYL]-1-(4-METHOXYPHENYL)-3-[(3,4,5-TRIMETHOXYPHENYL)METHYL]THIOUREA
TL;DR: 3-[2-(5-FLUORO-2-METHYL-1H-INDOL-3-YL)ETHYL]-1-(4-METHOXYPHENYL)-3-[(3,4,5-TRIMETHOXYPHENYL)METHYL]THIOUREA (CAS 687579-01-7) is a chemical compound with molecular formula C29H32FN3O4S and molecular weight 537.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2-(5-fluoro-2-methyl-1H-indol-3-yl)ethyl]-3-(4-methoxyphenyl)-1-[(3,4,5-trimethoxyphenyl)methyl]thiourea
Also Known As: 3-[2-(5-FLUORO-2-METHYL-1H-INDOL-3-YL)ETHYL]-1-(4-METHOXYPHENYL)-3-[(3,4,5-TRIMETHOXYPHENYL)METHYL]THIOUREA, F0591-1146, 1-(2-(5-fluoro-2-methyl-1H-indol-3-yl)ethyl)-3-(4-methoxyphenyl)-1-(3,4,5-trimethoxybenzyl)thiourea, 1-[2-(5-fluoro-2-methyl-1H-indol-3-yl)ethyl]-3-(4-methoxyphenyl)-1-[(3,4,5-trimethoxyphenyl)methyl]thiourea
| Molecular Formula | C29H32FN3O4S |
|---|---|
| Molecular Weight | 537.21 g/mol |
| LogP | 6.09152 |
| Topological Polar Surface Area | 67.98 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 10 |
| Exact Mass | 537.2098 |
| Heavy Atoms | 38 |
| Complexity | 1396.6133 |
Chemical Identifiers
| CAS Number | 687579-01-7 |
|---|---|
| SMILES | CC1=C(C2=C(N1)C=CC(=C2)F)CCN(CC3=CC(=C(C(=C3)OC)OC)OC)C(=S)NC4=CC=C(C=C4)OC |
Product Overview
3-[2-(5-FLUORO-2-METHYL-1H-INDOL-3-YL)ETHYL]-1-(4-METHOXYPHENYL)-3-[(3,4,5-TRIMETHOXYPHENYL)METHYL]THIOUREA (CAS 687579-01-7), with molecular formula C29H32FN3O4S and molecular weight 537.21 g/mol. IUPAC: 1-[2-(5-fluoro-2-methyl-1H-indol-3-yl)ethyl]-3-(4-methoxyphenyl)-1-[(3,4,5-trimethoxyphenyl)methyl]thiourea.
Chemical Property Profile of 3-[2-(5-FLUORO-2-METHYL-1H-INDOL-3-YL)ETHYL]-1-(4-METHOXYPHENYL)-3-[(3,4,5-TRIMETHOXYPHENYL)METHYL]THIOUREA
Property Insights of 3-[2-(5-FLUORO-2-METHYL-1H-INDOL-3-YL)ETHYL]-1-(4-METHOXYPHENYL)-3-[(3,4,5-TRIMETHOXYPHENYL)METHYL]THIOUREA
The XLogP value of 6.09152 indicates that 3-[2-(5-FLUORO-2-METHYL-1H-INDOL-3-YL)ETHYL]-1-(4-METHOXYPHENYL)-3-[(3,4,5-TRIMETHOXYPHENYL)METHYL]THIOUREA is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.98 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[2-(5-FLUORO-2-METHYL-1H-INDOL-3-YL)ETHYL]-1-(4-METHOXYPHENYL)-3-[(3,4,5-TRIMETHOXYPHENYL)METHYL]THIOUREA. Following Lipinski's Rule of Five, 3-[2-(5-FLUORO-2-METHYL-1H-INDOL-3-YL)ETHYL]-1-(4-METHOXYPHENYL)-3-[(3,4,5-TRIMETHOXYPHENYL)METHYL]THIOUREA has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-[2-(5-FLUORO-2-METHYL-1H-INDOL-3-YL)ETHYL]-1-(4-METHOXYPHENYL)-3-[(3,4,5-TRIMETHOXYPHENYL)METHYL]THIOUREA?
The CAS number of 3-[2-(5-FLUORO-2-METHYL-1H-INDOL-3-YL)ETHYL]-1-(4-METHOXYPHENYL)-3-[(3,4,5-TRIMETHOXYPHENYL)METHYL]THIOUREA is 687579-01-7.
What is the molecular formula of 3-[2-(5-FLUORO-2-METHYL-1H-INDOL-3-YL)ETHYL]-1-(4-METHOXYPHENYL)-3-[(3,4,5-TRIMETHOXYPHENYL)METHYL]THIOUREA?
The molecular formula of 3-[2-(5-FLUORO-2-METHYL-1H-INDOL-3-YL)ETHYL]-1-(4-METHOXYPHENYL)-3-[(3,4,5-TRIMETHOXYPHENYL)METHYL]THIOUREA is C29H32FN3O4S.
What is the molecular weight of 3-[2-(5-FLUORO-2-METHYL-1H-INDOL-3-YL)ETHYL]-1-(4-METHOXYPHENYL)-3-[(3,4,5-TRIMETHOXYPHENYL)METHYL]THIOUREA?
The molecular weight of 3-[2-(5-FLUORO-2-METHYL-1H-INDOL-3-YL)ETHYL]-1-(4-METHOXYPHENYL)-3-[(3,4,5-TRIMETHOXYPHENYL)METHYL]THIOUREA is 537.21 g/mol.
Where can I buy 3-[2-(5-FLUORO-2-METHYL-1H-INDOL-3-YL)ETHYL]-1-(4-METHOXYPHENYL)-3-[(3,4,5-TRIMETHOXYPHENYL)METHYL]THIOUREA?
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Does KEHONG BIO offer custom synthesis for 3-[2-(5-FLUORO-2-METHYL-1H-INDOL-3-YL)ETHYL]-1-(4-METHOXYPHENYL)-3-[(3,4,5-TRIMETHOXYPHENYL)METHYL]THIOUREA?
Yes, KEHONG BIO provides custom synthesis services for 3-[2-(5-FLUORO-2-METHYL-1H-INDOL-3-YL)ETHYL]-1-(4-METHOXYPHENYL)-3-[(3,4,5-TRIMETHOXYPHENYL)METHYL]THIOUREA and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.