N~4~-(3-methyl-1H-indazol-6-yl)-N~2~-(3,4,5-trimethoxyphenyl)pyrimidine-2,4-diamine
4-N-(3-methyl-2H-indazol-6-yl)-2-N-(3,4,5-trimethoxyphenyl)pyrimidine-2,4-diamine
Molecular Identity
N~4~-(3-methyl-1H-indazol-6-yl)-N~2~-(3,4,5-trimethoxyphenyl)pyrimidine-2,4-diamine
4-N-(3-methyl-2H-indazol-6-yl)-2-N-(3,4,5-trimethoxyphenyl)pyrimidine-2,4-diamine
PubChem CID: 9822610
2D Structure
Properties
C21H22N6O3
Molecular Formula
406.40
Molecular Weight
g/mol
406.1753
Exact Mass
Da
3.9
XLogP
Drug-like (Lipinski: < 5)
106
TPSA
Good oral absorption (< 140 A²)
3
H-Bond Donors
8
H-Bond Acceptors
529
Complexity
SMILES
Canonical SMILES
SMILES: CC1=C2C=CC(=CC2=NN1)NC3=NC(=NC=C3)NC4=CC(=C(C(=C4)OC)OC)OCIsomeric SMILES
SMILES: CC1=C2C=CC(=CC2=NN1)NC3=NC(=NC=C3)NC4=CC(=C(C(=C4)OC)OC)OCSynonyms(20)
N~4~-(3-Methyl-1h-Indazol-6-Yl)-N~2~-(3,4,5-Trimethoxyphenyl)pyrimidine-2,4-Diaminen4-(3-methyl-1h-indazol-6-yl)-n2-(3,4,5-trimethoxyphenyl)pyrimidine-2,4-diamineRefChem:854994GW612286Xpyrimidine, 5a3cjfSAVCHEMBL479079SCHEMBL21067484BDBM264794o78GLXC-25330HMS3303E14HMS3305P05NSC756278
Data from PubChem (NCBI)
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Molecular Structure
N~4~-(3-methyl-1H-indazol-6-yl)-N~2~-(3,4,5-trimethoxyphenyl)pyrimidine-2,4-diamine
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Drug Network
Trials and conditions connected to N~4~-(3-methyl-1H-indazol-6-yl)-N~2~-(3,4,5-trimethoxyphenyl)pyrimidine-2,4-diamine
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