Mar 99

HCID 9817898

Completing data — usually done within a minute

Basic information

CAS
98772-05-5
Standard SMILES
CC(C)COc1ccccc1Nc1ncc(C(=O)O)c(=O)[nH]1
InChIKey
ZKPYFMVPKVVIRW-UHFFFAOYSA-N
Molecular formula
C15H17N3O4
Average molar mass
303.31 g/mol

Names & identifiers

Preferred name
Mar 99
IUPAC
2-[2-(2-methylpropoxy)anilino]-6-oxo-1H-pyrimidine-5-carboxylic acid

Names & synonyms

MAR-99V20L9HCC73RefChem:9253185-Pyrimidinecarboxylic acid, 1,4-dihydro-2-((2-(2-methylpropoxy)phenyl)amino)-4-oxo-98772-05-5Mar 991,6-dihydro-2-[2-(2-methylpropoxy)anilino]-6-oxo-5-pyrimidinecarboxylic acidSCHEMBL6456385ZKPYFMVPKVVIRW-UHFFFAOYSA-NQ272914262-[2-(2-methylpropoxy)anilino]-6-oxo-1H-pyrimidine-5-carboxylic acid5-PYRIMIDINECARBOXYLIC ACID, 1,6-DIHYDRO-2-((2-(2-METHYLPROPOXY)PHENYL)AMINO)-6-OXO-

Database identifiers

CAS
98772-05-5
PubChem CID
9817898
UNII
V20L9HCC73
Nikkaji
J580.218K

Properties

Computed structural propertiesFilling in

XLogP
2.2
Topological polar surface area
100 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
5
Rotatable bonds
6
Heavy atoms
22

Related reactions

3 records

Compound notes

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