4(3H)-Quinazolinone, 7-butoxy-3-(2-(diethylamino)ethyl)-, oxalate (1:1)

HCID 64087

Notes Reactions

Substructure search Find similar structures

Basic information

CAS: 35739-56-1
Standard SMILES: CCCCOc1ccc2c(=O)n(CCN(CC)CC)cnc2c1.O=C(O)C(=O)O
InChIKey: XVYZGSVRXWOPCV-UHFFFAOYSA-N
Molecular formula: C20H29N3O6
Average molar mass: 407.5 g/mol
Monoisotopic mass: 407.20563565

Names & identifiers

Preferred name: 4(3H)-Quinazolinone, 7-butoxy-3-(2-(diethylamino)ethyl)-, oxalate (1:1)
IUPAC: 7-butoxy-3-[2-(diethylamino)ethyl]quinazolin-4-one;oxalic acid

Names & synonyms

35739-56-17-Butoxy-3-(2-(diethylamino)ethyl)-4(3H)-quinazolinone oxalate4(3H)-Quinazolinone, 7-butoxy-3-(2-(diethylamino)ethyl)-, oxalate (1:1)DTXSID201892807-n-Butoxy-3-(2-diethylaminoethyl)-3,4-dihydro-4-oxoquinazoline oxalateRefChem:284316DTXCID50111771Oxalic acid--7-butoxy-3-[2-(diethylamino)ethyl]quinazolin-4(3H)-one (1/1)

Database identifiers

CAS: 35739-56-1
PubChem CID: 64087
DTXSID: DTXSID20189280

Properties

Computed structural properties

Topological polar surface area: 120 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 8
Rotatable bonds: 10
Heavy atoms: 29
Formal charge: 0
Complexity: 467

Related reactions

0 records

New reaction record

No reaction records under the current filter.

Compound notes

Loading…