1-Isopropyl-4-oxo-1,4-dihydro-3-quinoline carboxylic acid
CAS 53977-47-2 MFCD01315709
化学结构图
SMILES: CC(C)N1C=C(C(O)=O)C(=O)C2=CC=CC=C12
化学属性
| Mol. Formula | C13H13NO3 |
|---|---|
| Mol. Weight | 231 |
| Melting Point | 200 - 203 (°C) |
别名和识别编码
| Chemical Name | 1-Isopropyl-4-oxo-1,4-dihydro-3-quinoline carboxylic acid |
|---|---|
| CAS Number | 53977-47-2 |
| Alfabeta Name | ISOPROPYLOXODIHYDROQUINOLINECARBOXYLICACID 14143-------, |
| MDL Number | MFCD01315709 |
| Synonym | 1-isopropyl-4-oxo-1,4-dihydro-3-quinolinecarboxylic acid |
| Chemical Name Translation | |
| PubChem Substance ID | 329789669 |
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分类
- {KO} Ketones
- {KO} CarboxylicAcids
- {SNA} Amines, Building Blocks, C13, Chemical Synthesis, Nitrogen Compounds, Organic Building Blocks
安全信息
药物吸收、分布、代谢与排泄(ADME)
Lipinski's Rule of 3
Y
Lipinski's Rule of 5
Y
H-bond Acceptors
3
Rotatable Bonds
2
H-bond Donors
1
LogP
1
