TL;DR: (2E)-2-{[5-(4-chlorophenyl)furan-2-yl]methylidene}hydrazinecarbothioamide (CAS 1632320-72-9) is a chemical compound with molecular formula C12H10ClN3OS and molecular weight 279.02332 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[(E)-[5-(4-chlorophenyl)furan-2-yl]methylideneamino]thiourea
Also Known As: UNKNOWN_FIELD_TYPE, P5i-7, BAS 00246637, UPCMLD0ENAT0502-2382:001, BB 0247014
| Molecular Formula | C12H10ClN3OS |
| Molecular Weight | 279.02332 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 95.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 279.02332 Da |
| Heavy Atoms | 18 |
| Complexity | 318.0 |
| SMILES | C1=CC(=CC=C1C2=CC=C(O2)/C=N/NC(=S)N)Cl |
| InChIKey | OYEQJQNRMFKNDG-VIZOYTHASA-N |
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2E)-2-{[5-(4-chlorophenyl)furan-2-yl]methylidene}hydrazinecarbothioamide. The TPSA of 95.6 Ų falls within the moderate polarity range, balancing permeability and solubility for (2E)-2-{[5-(4-chlorophenyl)furan-2-yl]methylidene}hydrazinecarbothioamide. Following Lipinski's Rule of Five, (2E)-2-{[5-(4-chlorophenyl)furan-2-yl]methylidene}hydrazinecarbothioamide has 2 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 (2E)-2-{[5-(4-chlorophenyl)furan-2-yl]methylidene}hydrazinecarbothioamide is 1632320-72-9.
The molecular formula of (2E)-2-{[5-(4-chlorophenyl)furan-2-yl]methylidene}hydrazinecarbothioamide is C12H10ClN3OS.
The molecular weight of (2E)-2-{[5-(4-chlorophenyl)furan-2-yl]methylidene}hydrazinecarbothioamide is 279.02332 g/mol.
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