N-(4-(2-(5-(1,3-Dioxolan-2-yl)pyridin-2-yl)thieno[3,2-b]pyridin-7-yloxy)-3-fluorophenyl)-N-phenylcyclopropane-1,1-dicarboxamide
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Basic information
- Standard SMILES
NC(=O)C1(C(=O)N(c2ccccc2)c2ccc(Oc3ccnc4cc(-c5ccc(C6OCCO6)cn5)sc34)c(F)c2)CC1- InChIKey
OZMUTBPVTYSWQD-UHFFFAOYSA-N- Molecular formula
- C32H25FN4O5S
- Average molar mass
- 596.6 g/mol
- Monoisotopic mass
- 596.15296925
Names & identifiers
- Preferred name
- N-(4-(2-(5-(1,3-Dioxolan-2-yl)pyridin-2-yl)thieno[3,2-b]pyridin-7-yloxy)-3-fluorophenyl)-N-phenylcyclopropane-1,1-dicarboxamide
- IUPAC
- 1-N'-[4-[2-[5-(1,3-dioxolan-2-yl)-2-pyridinyl]thieno[3,2-b]pyridin-7-yl]oxy-3-fluorophenyl]-1-N'-phenylcyclopropane-1,1-dicarboxamide
Names & synonyms
SCHEMBL107514OZMUTBPVTYSWQD-UHFFFAOYSA-NN-(4-(2-(5-(1,3-Dioxolan-2-yl)pyridin-2-yl)thieno[3,2-b]pyridin-7-yloxy)-3-fluorophenyl)-N-phenylcyclopropane-1,1-dicarboxamide
Database identifiers
- PubChem CID
- 66599014
Properties
Computed structural propertiesFilling in
- XLogP
- 3.9
- Topological polar surface area
- 145 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 8
- Heavy atoms
- 43
- Formal charge
- 0
- Complexity
- 1,010
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Related reactions
13 records
Compound notes
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