ZK2MF4Dhk4
Basic information
- CAS
2922525-52-6- Standard SMILES
CC(C)Oc1ccc(-c2ncc(-c3ccc(CN4CC(C(=O)O)C4)cc3)[se]2)cc1Cl- InChIKey
ZGSGLPGQKHHLQT-UHFFFAOYSA-N- Molecular formula
- C23H23ClN2O3Se
- Average molar mass
- 489.9 g/mol
- Monoisotopic mass
- 490.05624
Names & identifiers
- Preferred name
- ZK2MF4Dhk4
- IUPAC
- 1-[[4-[2-(3-chloro-4-propan-2-yloxyphenyl)-1,3-selenazol-5-yl]phenyl]methyl]azetidine-3-carboxylic acid
Names & synonyms
ZK2MF4DHK41-[[4-[2-(3-Chloro-4-propan-2-yloxyphenyl)-1,3-selenazol-5-yl]phenyl]methyl]azetidine-3-carboxylic acid2922525-52-63-Azetidinecarboxylic acid, 1-[[4-[2-[3-chloro-4-(1-methylethoxy)phenyl]-5-selenazolyl]phenyl]methyl]-
Database identifiers
- CAS
2922525-52-6- PubChem CID
- 166559072
- UNII
- ZK2MF4DHK4
Properties
Computed structural properties
- Topological polar surface area
- 62.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 7
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 581
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Compound notes
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