DTXSID40955343

4,5-dihydroxy-3,6-bis(morpholin-4-ylmethyl)cyclohepta-2,4,6-trien-1-one

CAS: 33739-52-5

Molecular Formula	`C17H24N2O5`
Molecular Weight	336.4 g/mol
LogP	-1.7
Topological Polar Surface Area	82.5 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	7
Rotatable Bonds	4
Exact Mass	336.16852
Heavy Atoms	24
Complexity	522.0

Chemical Identifiers

CAS Number	33739-52-5
SMILES	`C1COCCN1CC2=CC(=O)C=C(C(=C2O)O)CN3CCOCC3`
InChIKey	`IJRTWWQQVZZCKJ-UHFFFAOYSA-N`

📖 Product Overview

DTXSID40955343 (CAS: 33739-52-5) is a chemical compound with molecular formula C17H24N2O5 and molecular weight 336.4 g/mol. Its IUPAC systematic name is 4,5-dihydroxy-3,6-bis(morpholin-4-ylmethyl)cyclohepta-2,4,6-trien-1-one. LogP -1.7 Topological Polar Surface Area 82.5 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 7 Rotatable Bonds 4 Exact Mass 336.16852 Heavy Atoms 24 Complexity 522.0 InChI Key: IJRTWWQQVZZCKJ-UHFFFAOYSA-N. SMILES: C1COCCN1CC2=CC(=O)C=C(C(=C2O)O)CN3CCOCC3.

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