TL;DR: (E)-N-(3,4-dimethylbenzo[d]thiazol-2(3H)-ylidene)benzo[d]thiazole-2-carboxamide (CAS 1005937-37-0) is a chemical compound with molecular formula C17H13N3OS2 and molecular weight 339.05002 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(3,4-dimethyl-1,3-benzothiazol-2-ylidene)-1,3-benzothiazole-2-carboxamide
Also Known As: (E)-N-(3,4-dimethylbenzo[d]thiazol-2(3H)-ylidene)benzo[d]thiazole-2-carboxamide, F1381-0178, N-(3,4-dimethyl-1,3-benzothiazol-2-ylidene)-1,3-benzothiazole-2-carboxamide, N-[(2E)-3,4-dimethyl-2,3-dihydro-1,3-benzothiazol-2-ylidene]-1,3-benzothiazole-2-carboxamide
| Molecular Formula | C17H13N3OS2 |
| Molecular Weight | 339.05002 g/mol |
| XLogP | 4.7 |
| Topological Polar Surface Area (TPSA) | 99.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 339.05002 Da |
| Heavy Atoms | 23 |
| Complexity | 512.0 |
| SMILES | CC1=C2C(=CC=C1)SC(=NC(=O)C3=NC4=CC=CC=C4S3)N2C |
| InChIKey | KJIDXIYIYZLLHN-UHFFFAOYSA-N |
The XLogP value of 4.7 indicates that (E)-N-(3,4-dimethylbenzo[d]thiazol-2(3H)-ylidene)benzo[d]thiazole-2-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 99.1 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-N-(3,4-dimethylbenzo[d]thiazol-2(3H)-ylidene)benzo[d]thiazole-2-carboxamide. Following Lipinski's Rule of Five, (E)-N-(3,4-dimethylbenzo[d]thiazol-2(3H)-ylidene)benzo[d]thiazole-2-carboxamide has 0 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 (E)-N-(3,4-dimethylbenzo[d]thiazol-2(3H)-ylidene)benzo[d]thiazole-2-carboxamide is 1005937-37-0.
The molecular formula of (E)-N-(3,4-dimethylbenzo[d]thiazol-2(3H)-ylidene)benzo[d]thiazole-2-carboxamide is C17H13N3OS2.
The molecular weight of (E)-N-(3,4-dimethylbenzo[d]thiazol-2(3H)-ylidene)benzo[d]thiazole-2-carboxamide is 339.05002 g/mol.
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