SC 10644
Basic information
- CAS
79329-89-8- Standard SMILES
O=C(OCCN1CCCC1)c1ccc(C(c2ccccc2)c2ccccc2)cc1- InChIKey
HUPPOCKZKVYSFW-UHFFFAOYSA-N- Molecular formula
- C26H27NO2
- Average molar mass
- 385.5 g/mol
- Monoisotopic mass
- 385.2041791
Names & identifiers
- Preferred name
- SC 10644
- IUPAC
- 2-pyrrolidin-1-ylethyl 4-benzhydrylbenzoate
Names & synonyms
SC 1064479329-89-8SC-10644DTXSID50229628Benzoic acid, 4-(diphenylmethyl)-, 2-(1-pyrrolidinyl)ethyl esterRefChem:181593DTXCID001521192-(1-Pyrrolidinyl)ethyltriphenylmethane-4-carboxylate2-(Pyrrolidin-1-yl)ethyl 4-(diphenylmethyl)benzoate
Database identifiers
- CAS
79329-89-8- PubChem CID
- 192209
- DTXSID
DTXSID50229628
Properties
Computed structural properties
- XLogP
- 5.7
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 8
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 463
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Compound notes
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