1-(2-methoxyphenyl)-5,7-dimethyl-3-[(2-methylphenyl)methyl]pyrido[2,3-d]pyrimidine-2,4-dione

C24H23N3O3 — CID 17250585

IUPAC1-(2-methoxyphenyl)-5,7-dimethyl-3-[(2-methylphenyl)methyl]pyrido[2,3-d]pyrimidine-2,4-dione
SMILESCOc1ccccc1-n1c(=O)n(Cc2ccccc2C)c(=O)c2c(C)cc(C)nc21
InChIInChI=1S/C24H23N3O3/c1-15-9-5-6-10-18(15)14-26-23(28)21-16(2)13-17(3)25-22(21)27(24(26)29)19-11-7-8-12-20(19)30-4/h5-13H,14H2,1-4H3
InChIKeyDHFDCVYATSDLJI-UHFFFAOYSA-N
MW401.47 g/mol
LogP3.53
Rot. Bonds4

About 1-(2-methoxyphenyl)-5,7-dimethyl-3-[(2-methylphenyl)methyl]pyrido[2,3-d]pyrimidine-2,4-dione

1-(2-methoxyphenyl)-5,7-dimethyl-3-[(2-methylphenyl)methyl]pyrido[2,3-d]pyrimidine-2,4-dione (PubChem CID 17250585) has the molecular formula C24H23N3O3 and a molecular weight of 401.47 g/mol. Its IUPAC name is 1-(2-methoxyphenyl)-5,7-dimethyl-3-[(2-methylphenyl)methyl]pyrido[2,3-d]pyrimidine-2,4-dione.

Molecular Properties

Compound Name1-(2-methoxyphenyl)-5,7-dimethyl-3-[(2-methylphenyl)methyl]pyrido[2,3-d]pyrimidine-2,4-dione
PubChem CID17250585
Molecular FormulaC24H23N3O3
Molecular Weight401.47 g/mol
Exact Mass401.17
IUPAC Name1-(2-methoxyphenyl)-5,7-dimethyl-3-[(2-methylphenyl)methyl]pyrido[2,3-d]pyrimidine-2,4-dione
SMILESCOc1ccccc1-n1c(=O)n(Cc2ccccc2C)c(=O)c2c(C)cc(C)nc21
InChIInChI=1S/C24H23N3O3/c1-15-9-5-6-10-18(15)14-26-23(28)21-16(2)13-17(3)25-22(21)27(24(26)29)19-11-7-8-12-20(19)30-4/h5-13H,14H2,1-4H3
InChIKeyDHFDCVYATSDLJI-UHFFFAOYSA-N
XLogP3.53
TPSA66.12 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500401.47
LogP ≤ 53.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyphenyl)-5,7-dimethyl-3-[(2-methylphenyl)methyl]pyrido[2,3-d]pyrimidine-2,4-dione?
The IUPAC name of 1-(2-methoxyphenyl)-5,7-dimethyl-3-[(2-methylphenyl)methyl]pyrido[2,3-d]pyrimidine-2,4-dione (CID 17250585) is 1-(2-methoxyphenyl)-5,7-dimethyl-3-[(2-methylphenyl)methyl]pyrido[2,3-d]pyrimidine-2,4-dione.
What is the SMILES notation for 1-(2-methoxyphenyl)-5,7-dimethyl-3-[(2-methylphenyl)methyl]pyrido[2,3-d]pyrimidine-2,4-dione?
The canonical SMILES for 1-(2-methoxyphenyl)-5,7-dimethyl-3-[(2-methylphenyl)methyl]pyrido[2,3-d]pyrimidine-2,4-dione is COc1ccccc1-n1c(=O)n(Cc2ccccc2C)c(=O)c2c(C)cc(C)nc21.
What is the InChIKey of 1-(2-methoxyphenyl)-5,7-dimethyl-3-[(2-methylphenyl)methyl]pyrido[2,3-d]pyrimidine-2,4-dione?
The InChIKey is DHFDCVYATSDLJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23N3O3/c1-15-9-5-6-10-18(15)14-26-23(28)21-16(2)13-17(3)25-22(21)27(24(26)29)19-11-7-8-12-20(19)30-4/h5-13H,14H2,1-4H3.
What are the key properties of 1-(2-methoxyphenyl)-5,7-dimethyl-3-[(2-methylphenyl)methyl]pyrido[2,3-d]pyrimidine-2,4-dione?
1-(2-methoxyphenyl)-5,7-dimethyl-3-[(2-methylphenyl)methyl]pyrido[2,3-d]pyrimidine-2,4-dione has a molecular weight of 401.47 g/mol, XLogP of 3.53, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyphenyl)-5,7-dimethyl-3-[(2-methylphenyl)methyl]pyrido[2,3-d]pyrimidine-2,4-dione is sourced from PubChem (CID 17250585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).