TL;DR: N-(4-anilinophenyl)-N'-[3-(2-oxo-1-pyrrolidinyl)propyl]thiourea (CAS 774554-04-0) is a chemical compound with molecular formula C20H24N4OS and molecular weight 368.16708 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(4-anilinophenyl)-3-[3-(2-oxopyrrolidin-1-yl)propyl]thiourea
Also Known As: N-(4-anilinophenyl)-N'-[3-(2-oxo-1-pyrrolidinyl)propyl]thiourea, 1-(4-anilinophenyl)-3-[3-(2-oxopyrrolidin-1-yl)propyl]thiourea, 1-(4-anilinophenyl)-3-[3-(2-ketopyrrolidino)propyl]thiourea, N-[3-(2-Oxo-1-pyrrolidinyl)propyl]-N'-[4-(phenylamino)phenyl]thiourea, 1-(4-anilinophenyl)-3-[3-(2-oxo-1-pyrrolidinyl)propyl]thiourea
| Molecular Formula | C20H24N4OS |
| Molecular Weight | 368.16708 g/mol |
| XLogP | 3.0 |
| Topological Polar Surface Area (TPSA) | 88.5 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 368.16708 Da |
| Heavy Atoms | 26 |
| Complexity | 459.0 |
| SMILES | C1CC(=O)N(C1)CCCNC(=S)NC2=CC=C(C=C2)NC3=CC=CC=C3 |
| InChIKey | BYTKNYAFNWYZAU-UHFFFAOYSA-N |
The XLogP value of 3.0 indicates that N-(4-anilinophenyl)-N'-[3-(2-oxo-1-pyrrolidinyl)propyl]thiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.5 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(4-anilinophenyl)-N'-[3-(2-oxo-1-pyrrolidinyl)propyl]thiourea. Following Lipinski's Rule of Five, N-(4-anilinophenyl)-N'-[3-(2-oxo-1-pyrrolidinyl)propyl]thiourea has 3 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of N-(4-anilinophenyl)-N'-[3-(2-oxo-1-pyrrolidinyl)propyl]thiourea is 774554-04-0.
The molecular formula of N-(4-anilinophenyl)-N'-[3-(2-oxo-1-pyrrolidinyl)propyl]thiourea is C20H24N4OS.
The molecular weight of N-(4-anilinophenyl)-N'-[3-(2-oxo-1-pyrrolidinyl)propyl]thiourea is 368.16708 g/mol.
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