Basic information
- CAS
445384-62-3- Standard SMILES
Cc1cc(NC(=O)c2sc3nc4c(c(-c5ccc(Cl)cc5)c3c2N)CCCC4)no1- InChIKey
OHVCPZABGVEREV-UHFFFAOYSA-N- Molecular formula
- C22H19ClN4O2S
- Average molar mass
- 438.9 g/mol
- Monoisotopic mass
- 438.0917247
Names & identifiers
- Preferred name
- 3-amino-4-(4-chlorophenyl)-N-(5-methyl-3-isoxazolyl)-5,6,7,8-tetrahydrothieno[2,3-b]quinoline-2-carboxamide
- IUPAC
- 3-amino-4-(4-chlorophenyl)-N-(5-methyl-1,2-oxazol-3-yl)-5,6,7,8-tetrahydrothieno[2,3-b]quinoline-2-carboxamide
- English name
- 3-amino-4-(4-chlorophenyl)-N-(5-methyl-3-isoxazolyl)-5,6,7,8-tetrahydrothieno[2,3-b]quinoline-2-carboxamide
- Molecular formula
- C22H19ClN4O2S
- Molecular weight
- 438.92986
Names & synonyms
3-amino-4-(4-chlorophenyl)-N-(5-methyl-3-isoxazolyl)-5,6,7,8-tetrahydrothieno[2,3-b]quinoline-2-carboxamideMFCD03234658AKOS001662609AM-807/149573993-amino-4-(4-chlorophenyl)-N-(5-methyl-1,2-oxazol-3-yl)-5,6,7,8-tetrahydrothieno[2,3-b]quinoline-2-carboxamide3-AMINO-4-(4-CHLOROPHENYL)-N-(5-METHYL-1,2-OXAZOL-3-YL)-5H,6H,7H,8H-THIENO[2,3-B]QUINOLINE-2-CARBOXAMIDE
Database identifiers
- CAS
445384-62-3- PubChem CID
- 1201902
Properties
Computed structural properties
- XLogP
- 5.9
- Topological polar surface area
- 122 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 634
Chemistry & industry
Suppliers1 total
SPECS[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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