TL;DR: [(4-Methylanilino)-phenylmethylidene]thiourea (CAS 122164-30-1) is a chemical compound with molecular formula C15H15N3S and molecular weight 269.09866 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[(4-methylanilino)-phenylmethylidene]thiourea
Also Known As: (Phenyl-p-tolylimino-methyl)-thiourea, [(4-methylanilino)-phenylmethylidene]thiourea, (Z)-N-carbamothioyl-N'-(p-tolyl)benzimidamide
| Molecular Formula | C15H15N3S |
| Molecular Weight | 269.09866 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 82.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 269.09866 Da |
| Heavy Atoms | 19 |
| Complexity | 326.0 |
| SMILES | CC1=CC=C(C=C1)NC(=NC(=S)N)C2=CC=CC=C2 |
| InChIKey | DNZRAOJYGQTUGD-UHFFFAOYSA-N |
The XLogP value of 3.2 indicates that [(4-Methylanilino)-phenylmethylidene]thiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 82.5 Ų falls within the moderate polarity range, balancing permeability and solubility for [(4-Methylanilino)-phenylmethylidene]thiourea. Following Lipinski's Rule of Five, [(4-Methylanilino)-phenylmethylidene]thiourea has 2 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of [(4-Methylanilino)-phenylmethylidene]thiourea is 122164-30-1.
The molecular formula of [(4-Methylanilino)-phenylmethylidene]thiourea is C15H15N3S.
The molecular weight of [(4-Methylanilino)-phenylmethylidene]thiourea is 269.09866 g/mol.
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