TL;DR: BAS 02867258 (CAS 1164474-32-1) is a chemical compound with molecular formula C21H21N3O5S and molecular weight 427.12018 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-[[3-ethyl-2-(2-methoxyphenyl)imino-4-oxo-1,3-thiazinane-6-carbonyl]amino]benzoic acid
Also Known As: BAS 02867258, 4-[[3-ethyl-2-(2-methoxyphenyl)imino-4-oxo-1,3-thiazinane-6-carbonyl]amino]benzoic acid, 4-[({(2Z)-3-ethyl-2-[(2-methoxyphenyl)imino]-4-oxo-1,3-thiazinan-6-yl}carbonyl)amino]benzoic acid, (Z)-4-(3-ethyl-2-((2-methoxyphenyl)imino)-4-oxo-1,3-thiazinane-6-carboxamido)benzoic acid, 4-[(2Z)-3-ETHYL-2-[(2-METHOXYPHENYL)IMINO]-4-OXO-1,3-THIAZINANE-6-AMIDO]BENZOIC ACID
| Molecular Formula | C21H21N3O5S |
| Molecular Weight | 427.12018 g/mol |
| XLogP | 2.8 |
| Topological Polar Surface Area (TPSA) | 134.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 427.12018 Da |
| Heavy Atoms | 30 |
| Complexity | 678.0 |
| SMILES | CCN1C(=O)CC(SC1=NC2=CC=CC=C2OC)C(=O)NC3=CC=C(C=C3)C(=O)O |
| InChIKey | MGIYTZWSQVRRQJ-UHFFFAOYSA-N |
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 02867258. The TPSA of 134.0 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 02867258. Following Lipinski's Rule of Five, BAS 02867258 has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of BAS 02867258 is 1164474-32-1.
The molecular formula of BAS 02867258 is C21H21N3O5S.
The molecular weight of BAS 02867258 is 427.12018 g/mol.
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