TL;DR: 7-Methylbenzo[1,2-d:3,4-d']bis(thiazole)-2-amine (CAS 10023-31-1) is a chemical compound with molecular formula C9H7N3S2 and molecular weight 221.00813 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
7-methyl-[1,3]thiazolo[5,4-e][1,3]benzothiazol-2-amine
Also Known As: 7-methylbenzo[1,2-d:3,4-d']bis(thiazole)-2-amine, 7-Methyl-benzo[1,2-d;3,4-d']bisthiazol-2-ylamine, 7-methyl-[1,3]thiazolo[5,4-e][1,3]benzothiazol-2-amine, benzo[1,2-d:3,4-d']bisthiazol-2-amine,7-methyl-, L-3174
| Molecular Formula | C9H7N3S2 |
| Molecular Weight | 221.00813 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 108.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 221.00813 Da |
| Heavy Atoms | 14 |
| Complexity | 238.0 |
| SMILES | CC1=NC2=C(S1)C=CC3=C2SC(=N3)N |
| InChIKey | UCLUWGOFEQZGBZ-UHFFFAOYSA-N |
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7-Methylbenzo[1,2-d:3,4-d']bis(thiazole)-2-amine. The TPSA of 108.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 7-Methylbenzo[1,2-d:3,4-d']bis(thiazole)-2-amine. Following Lipinski's Rule of Five, 7-Methylbenzo[1,2-d:3,4-d']bis(thiazole)-2-amine has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 7-Methylbenzo[1,2-d:3,4-d']bis(thiazole)-2-amine is 10023-31-1.
The molecular formula of 7-Methylbenzo[1,2-d:3,4-d']bis(thiazole)-2-amine is C9H7N3S2.
The molecular weight of 7-Methylbenzo[1,2-d:3,4-d']bis(thiazole)-2-amine is 221.00813 g/mol.
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