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Pyrido(2,3-d)pyrimidine-5-carboxylic acid, 1,2,3,4-tetrahydro-2,4-dioxo-7-methyl-3-phenyl-1-(3-(4-phenyl-1-piperazinyl)propyl)-, ethyl ester

HCID 3073205
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Basic information

CAS
147297-03-8
Standard SMILES
CCOC(=O)c1cc(C)nc2c1c(=O)n(-c1ccccc1)c(=O)n2CCCN1CCN(c2ccccc2)CC1
InChIKey
DMNVXBJVUHTMDJ-UHFFFAOYSA-N
Molecular formula
C30H33N5O4
Average molar mass
527.6 g/mol
Monoisotopic mass
527.25325455

Names & identifiers

Preferred name
Pyrido(2,3-d)pyrimidine-5-carboxylic acid, 1,2,3,4-tetrahydro-2,4-dioxo-7-methyl-3-phenyl-1-(3-(4-phenyl-1-piperazinyl)propyl)-, ethyl ester
IUPAC
ethyl 7-methyl-2,4-dioxo-3-phenyl-1-[3-(4-phenylpiperazin-1-yl)propyl]pyrido[2,3-d]pyrimidine-5-carboxylate

Names & synonyms

147297-03-8Pyrido(2,3-d)pyrimidine-5-carboxylic acid, 1,2,3,4-tetrahydro-2,4-dioxo-7-methyl-3-phenyl-1-(3-(4-phenyl-1-piperazinyl)propyl)-, ethyl esterDTXSID70163656RefChem:377353DTXCID4086147Ethyl 7-methyl-2,4-dioxo-3-phenyl-1-[3-(4-phenylpiperazin-1-yl)propyl]-1,2,3,4-tetrahydropyrido[2,3-d]pyrimidine-5-carboxylate

Database identifiers

CAS
147297-03-8
PubChem CID
3073205
DTXSID
DTXSID70163656
Nikkaji
J522.179J

Properties

Computed structural properties

XLogP
4.2
Topological polar surface area
86.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
7
Rotatable bonds
9
Heavy atoms
39
Formal charge
0
Complexity
850

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