TL;DR: N'-[(E)-(4-chlorophenyl)methylideneamino]-N-(6-methoxy-1,3-benzothiazol-2-yl)butanediamide (CAS 134328-51-1) is a chemical compound with molecular formula C19H17ClN4O3S and molecular weight 416.07098 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N'-[(E)-(4-chlorophenyl)methylideneamino]-N-(6-methoxy-1,3-benzothiazol-2-yl)butanediamide
Also Known As: N'-[(E)-(4-chlorophenyl)methylideneamino]-N-(6-methoxy-1,3-benzothiazol-2-yl)butanediamide, (E)-4-(2-(4-chlorobenzylidene)hydrazinyl)-N-(6-methoxybenzo[d]thiazol-2-yl)-4-oxobutanamide
| Molecular Formula | C19H17ClN4O3S |
| Molecular Weight | 416.07098 g/mol |
| XLogP | 3.3 |
| Topological Polar Surface Area (TPSA) | 121.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 416.07098 Da |
| Heavy Atoms | 28 |
| Complexity | 571.0 |
| SMILES | COC1=CC2=C(C=C1)N=C(S2)NC(=O)CCC(=O)N/N=C/C3=CC=C(C=C3)Cl |
| InChIKey | CRWYQCIXWXEDLG-SRZZPIQSSA-N |
The XLogP value of 3.3 indicates that N'-[(E)-(4-chlorophenyl)methylideneamino]-N-(6-methoxy-1,3-benzothiazol-2-yl)butanediamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 121.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N'-[(E)-(4-chlorophenyl)methylideneamino]-N-(6-methoxy-1,3-benzothiazol-2-yl)butanediamide. Following Lipinski's Rule of Five, N'-[(E)-(4-chlorophenyl)methylideneamino]-N-(6-methoxy-1,3-benzothiazol-2-yl)butanediamide has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of N'-[(E)-(4-chlorophenyl)methylideneamino]-N-(6-methoxy-1,3-benzothiazol-2-yl)butanediamide is 134328-51-1.
The molecular formula of N'-[(E)-(4-chlorophenyl)methylideneamino]-N-(6-methoxy-1,3-benzothiazol-2-yl)butanediamide is C19H17ClN4O3S.
The molecular weight of N'-[(E)-(4-chlorophenyl)methylideneamino]-N-(6-methoxy-1,3-benzothiazol-2-yl)butanediamide is 416.07098 g/mol.
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