Basic information
- CAS
606089-86-5- Standard SMILES
S=C(Nc1ccccc1Cl)N1CCCC(c2nc3ccccc3[nH]2)C1- InChIKey
HTYJKSOLLPTWKX-UHFFFAOYSA-N- Molecular formula
- C19H19ClN4S
- Average molar mass
- 370.9 g/mol
- Monoisotopic mass
- 370.1018955
Names & identifiers
- Preferred name
- 1-Piperidinecarbothioamide, 3-(1H-benzimidazol-2-YL)-N-(2-chlorophenyl)-
- IUPAC
- 3-(1H-benzimidazol-2-yl)-N-(2-chlorophenyl)piperidine-1-carbothioamide
- English name
- 1-Piperidinecarbothioamide,3-(1H-benzimidazol-2-yl)-N-(2-chlorophenyl)-(9CI)
- Molecular formula
- C19H19ClN4S
- Molecular weight
- 370.9
Names & synonyms
ASN 06593917AKOS000761779AKOS030481376606089-86-5DB-2684561-PIPERIDINECARBOTHIOAMIDE, 3-(1H-BENZIMIDAZOL-2-YL)-N-(2-CHLOROPHENYL)-1-Piperidinecarbothioamide,3-(1H-benzimidazol-2-yl)-N-(2-chlorophenyl)-(9CI)
Database identifiers
- CAS
606089-86-5- PubChem CID
- 3223945
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 76 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 476
Chemistry & industry
Suppliers1 total
CHEMSTEP[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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