N-(6-bromo-3'-isopropylspiro[chroman-2,1'-cyclopentane]-4-ylidene)cyanamide
Completing data — refresh the page later to see the latest
Basic information
- Standard SMILES
CC(C)C1CCC2(CC(=NC#N)c3cc(Br)ccc3O2)C1- InChIKey
QKVKUFBCJDIWEA-UHFFFAOYSA-N- Molecular formula
- C17H19BrN2O
- Average molar mass
- 347.2 g/mol
Names & identifiers
- Preferred name
- N-(6-bromo-3'-isopropylspiro[chroman-2,1'-cyclopentane]-4-ylidene)cyanamide
- IUPAC
- (6-bromo-3'-propan-2-ylspiro[3H-chromene-2,1'-cyclopentane]-4-ylidene)cyanamide
Names & synonyms
SCHEMBL1822517SCHEMBL2376478QKVKUFBCJDIWEA-UHFFFAOYSA-NN-(6-bromo-3'-isopropylspiro[chroman-2,1'-cyclopentane]-4-ylidene)cyanamide
Database identifiers
- PubChem CID
- 58424005
Properties
Computed structural propertiesFilling in
- XLogP
- 4.7
- Topological polar surface area
- 45.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 480
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
2 records
Compound notes
Loading…