Basic information
- Standard SMILES
CN(Cc1cc2nc(-c3cccc4[nH]ccc34)nc(N3CCOCC3)c2s1)S(=O)(=O)CCCCl- InChIKey
HINBBDQCYHNZNX-UHFFFAOYSA-N- Molecular formula
- C23H26ClN5O3S2
- Average molar mass
- 520.1 g/mol
Names & identifiers
- Preferred name
- 3-chloro-propane-1-sulfonic acid [2-(1H-indol-4-yl)-4-morpholin-4-yl-thieno[3,2-d]pyrimidin-6-ylmethyl]-methyl-amide
- IUPAC
- 3-chloro-N-[[2-(1H-indol-4-yl)-4-morpholin-4-ylthieno[3,2-d]pyrimidin-6-yl]methyl]-N-methylpropane-1-sulfonamide
Names & synonyms
SCHEMBL1861349HINBBDQCYHNZNX-UHFFFAOYSA-N3-chloro-propane-1-sulfonic acid [2-(1H-indol-4-yl)-4-morpholin-4-yl-thieno[3,2-d]pyrimidin-6-ylmethyl]-methyl-amide
Database identifiers
- PubChem CID
- 67190012
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 128 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 8
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 781
Related reactions
7 records
Compound notes
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