TL;DR: N-(1,3-benzothiazol-2-yl)-N'-butylbutanediamide (CAS 134328-42-0) is a chemical compound with molecular formula C15H19N3O2S and molecular weight 305.1198 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N'-(1,3-benzothiazol-2-yl)-N-butylbutanediamide
Also Known As: N'-(1,3-benzothiazol-2-yl)-N-butylbutanediamide, N1-(benzo[d]thiazol-2-yl)-N4-butylsuccinamide, N-(1,3-benzothiazol-2-yl)-N'-butylbutanediamide
| Molecular Formula | C15H19N3O2S |
| Molecular Weight | 305.1198 g/mol |
| XLogP | 2.3 |
| Topological Polar Surface Area (TPSA) | 99.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 305.1198 Da |
| Heavy Atoms | 21 |
| Complexity | 365.0 |
| SMILES | CCCCNC(=O)CCC(=O)NC1=NC2=CC=CC=C2S1 |
| InChIKey | RAMHFCAIVYSERZ-UHFFFAOYSA-N |
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(1,3-benzothiazol-2-yl)-N'-butylbutanediamide. The TPSA of 99.3 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(1,3-benzothiazol-2-yl)-N'-butylbutanediamide. Following Lipinski's Rule of Five, N-(1,3-benzothiazol-2-yl)-N'-butylbutanediamide has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of N-(1,3-benzothiazol-2-yl)-N'-butylbutanediamide is 134328-42-0.
The molecular formula of N-(1,3-benzothiazol-2-yl)-N'-butylbutanediamide is C15H19N3O2S.
The molecular weight of N-(1,3-benzothiazol-2-yl)-N'-butylbutanediamide is 305.1198 g/mol.
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