TL;DR: VU0494312-1 (CAS 1006287-66-6) is a chemical compound with molecular formula C14H15BrN2O2S and molecular weight 354.00375 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[6-bromo-3-(2-methoxyethyl)-1,3-benzothiazol-2-ylidene]cyclopropanecarboxamide
Also Known As: VU0494312-1, (Z)-N-(6-bromo-3-(2-methoxyethyl)benzo[d]thiazol-2(3H)-ylidene)cyclopropanecarboxamide, F1359-0746, N-[6-bromo-3-(2-methoxyethyl)-1,3-benzothiazol-2-ylidene]cyclopropanecarboxamide, N-[(2Z)-6-bromo-3-(2-methoxyethyl)-2,3-dihydro-1,3-benzothiazol-2-ylidene]cyclopropanecarboxamide
| Molecular Formula | C14H15BrN2O2S |
| Molecular Weight | 354.00375 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 67.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 354.00375 Da |
| Heavy Atoms | 20 |
| Complexity | 414.0 |
| SMILES | COCCN1C2=C(C=C(C=C2)Br)SC1=NC(=O)C3CC3 |
| InChIKey | DNFGWLCKBVAZBN-UHFFFAOYSA-N |
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for VU0494312-1. The TPSA of 67.2 Ų falls within the moderate polarity range, balancing permeability and solubility for VU0494312-1. Following Lipinski's Rule of Five, VU0494312-1 has 0 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 VU0494312-1 is 1006287-66-6.
The molecular formula of VU0494312-1 is C14H15BrN2O2S.
The molecular weight of VU0494312-1 is 354.00375 g/mol.
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