TL;DR: Hydrazinecarbothioamide, 2-[(3-bromophenyl)methylene]- (CAS 1346145-39-8) is a chemical compound with molecular formula C8H8BrN3S and molecular weight 256.96222 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[(3-bromophenyl)methylideneamino]thiourea
Also Known As: [(3-bromophenyl)methylideneamino]thiourea|3-Bromobenzaldehyde thiosemicarbazone|Hydrazinecarbothioamide, 2-[(3-bromophenyl)methylene]-|{[(3-bromophenyl)methylidene]amino}thiourea|2-[(3-Bromophenyl)methylidene]hydrazine-1-carbothioamide|(2E)-2-(3-BROMOBENZYLIDENE)HYDRAZINECARBIMIDOTHIOIC ACID
| Molecular Formula | C8H8BrN3S |
| Molecular Weight | 256.96222 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 82.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 256.96222 Da |
| Heavy Atoms | 13 |
| Complexity | 208.0 |
| SMILES | C1=CC(=CC(=C1)Br)C=NNC(=S)N |
| InChIKey | FGGWIXJNLRDBPW-UHFFFAOYSA-N |
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Hydrazinecarbothioamide, 2-[(3-bromophenyl)methylene]-. The TPSA of 82.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Hydrazinecarbothioamide, 2-[(3-bromophenyl)methylene]-. Following Lipinski's Rule of Five, Hydrazinecarbothioamide, 2-[(3-bromophenyl)methylene]- has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Hydrazinecarbothioamide, 2-[(3-bromophenyl)methylene]- is 1346145-39-8.
The molecular formula of Hydrazinecarbothioamide, 2-[(3-bromophenyl)methylene]- is C8H8BrN3S.
The molecular weight of Hydrazinecarbothioamide, 2-[(3-bromophenyl)methylene]- is 256.96222 g/mol.
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