TL;DR: N-(3-chloro-4-methoxyphenyl)-3-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)propanamide (CAS 900880-30-0) is a chemical compound with molecular formula C17H15ClN4O3 and molecular weight 358.08328 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(3-chloro-4-methoxyphenyl)-3-(4-oxo-1,2,3-benzotriazin-3-yl)propanamide
Also Known As: N-(3-chloro-4-methoxyphenyl)-3-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)propanamide, N-(3-chloro-4-methoxyphenyl)-3-(4-oxo-1,2,3-benzotriazin-3-yl)propanamide, N-(3-chloro-4-methoxyphenyl)-3-(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)propanamide
| Molecular Formula | C17H15ClN4O3 |
| Molecular Weight | 358.08328 g/mol |
| XLogP | 3.0 |
| Topological Polar Surface Area (TPSA) | 83.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 358.08328 Da |
| Heavy Atoms | 25 |
| Complexity | 530.0 |
| SMILES | COC1=C(C=C(C=C1)NC(=O)CCN2C(=O)C3=CC=CC=C3N=N2)Cl |
| InChIKey | ZXPQTCCZEDRARJ-UHFFFAOYSA-N |
The XLogP value of 3.0 indicates that N-(3-chloro-4-methoxyphenyl)-3-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)propanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.4 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(3-chloro-4-methoxyphenyl)-3-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)propanamide. Following Lipinski's Rule of Five, N-(3-chloro-4-methoxyphenyl)-3-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)propanamide 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 N-(3-chloro-4-methoxyphenyl)-3-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)propanamide is 900880-30-0.
The molecular formula of N-(3-chloro-4-methoxyphenyl)-3-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)propanamide is C17H15ClN4O3.
The molecular weight of N-(3-chloro-4-methoxyphenyl)-3-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)propanamide is 358.08328 g/mol.
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