Basic information
- Standard SMILES
CNCCC(c1ccc(Cl)c(Cl)c1)n1ncnn1- InChIKey
XENSJUHNMOKFGM-UHFFFAOYSA-N- Molecular formula
- C11H13Cl2N5
- Average molar mass
- 286.16 g/mol
Names & identifiers
- Preferred name
- [3-(3,4-Dichloro-phenyl)-3-tetrazol-2-yl-propyl]-methyl-amine
- IUPAC
- 3-(3,4-dichlorophenyl)-N-methyl-3-(tetrazol-2-yl)propan-1-amine
Names & synonyms
CHEMBL1224381[3-(3,4-Dichloro-phenyl)-3-tetrazol-2-yl-propyl]-methyl-amineSCHEMBL404885XENSJUHNMOKFGM-UHFFFAOYSA-NBDBM50325935rac-3-(3,4-dichlorophenyl)-N-methyl-3-(2H-tetrazol-2-yl)propan-1-amine
Database identifiers
- PubChem CID
- 44511399
- ChEMBL
CHEMBL1224381
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 55.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 256
Related reactions
3 records
Compound notes
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