4-(4-fluorophenyl)-N-(1H-indazol-5-yl)-2-(4-methoxyphenyl)-6-methyl-1,4-dihydropyrimidine-5-carboxamide

C26H22FN5O2 — CID 11590594

IUPAC4-(4-fluorophenyl)-N-(1H-indazol-5-yl)-2-(4-methoxyphenyl)-6-methyl-1,4-dihydropyrimidine-5-carboxamide
SMILESCOc1ccc(C2=NC(c3ccc(F)cc3)C(C(=O)Nc3ccc4[nH]ncc4c3)=C(C)N2)cc1
InChIInChI=1S/C26H22FN5O2/c1-15-23(26(33)30-20-9-12-22-18(13-20)14-28-32-22)24(16-3-7-19(27)8-4-16)31-25(29-15)17-5-10-21(34-2)11-6-17/h3-14,24H,1-2H3,(H,28,32)(H,29,31)(H,30,33)
InChIKeyBYZIOVDGVCHNOI-UHFFFAOYSA-N
MW455.49 g/mol
LogP4.71
Rot. Bonds5

About 4-(4-fluorophenyl)-N-(1H-indazol-5-yl)-2-(4-methoxyphenyl)-6-methyl-1,4-dihydropyrimidine-5-carboxamide

4-(4-fluorophenyl)-N-(1H-indazol-5-yl)-2-(4-methoxyphenyl)-6-methyl-1,4-dihydropyrimidine-5-carboxamide (PubChem CID 11590594) has the molecular formula C26H22FN5O2 and a molecular weight of 455.49 g/mol. Its IUPAC name is 4-(4-fluorophenyl)-N-(1H-indazol-5-yl)-2-(4-methoxyphenyl)-6-methyl-1,4-dihydropyrimidine-5-carboxamide.

Molecular Properties

Compound Name4-(4-fluorophenyl)-N-(1H-indazol-5-yl)-2-(4-methoxyphenyl)-6-methyl-1,4-dihydropyrimidine-5-carboxamide
PubChem CID11590594
Molecular FormulaC26H22FN5O2
Molecular Weight455.49 g/mol
Exact Mass455.18
IUPAC Name4-(4-fluorophenyl)-N-(1H-indazol-5-yl)-2-(4-methoxyphenyl)-6-methyl-1,4-dihydropyrimidine-5-carboxamide
SMILESCOc1ccc(C2=NC(c3ccc(F)cc3)C(C(=O)Nc3ccc4[nH]ncc4c3)=C(C)N2)cc1
InChIInChI=1S/C26H22FN5O2/c1-15-23(26(33)30-20-9-12-22-18(13-20)14-28-32-22)24(16-3-7-19(27)8-4-16)31-25(29-15)17-5-10-21(34-2)11-6-17/h3-14,24H,1-2H3,(H,28,32)(H,29,31)(H,30,33)
InChIKeyBYZIOVDGVCHNOI-UHFFFAOYSA-N
XLogP4.71
TPSA91.40 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500455.49
LogP ≤ 54.71
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze 4-(4-fluorophenyl)-N-(1H-indazol-5-yl)-2-(4-methoxyphenyl)-6-methyl-1,4-dihydropyrimidine-5-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(1H-indazol-5-yl)-2-(4-methoxyphenyl)-4,6-dimethyl-1,4-dihydropyrimidine-5-carboxamide
CID 11545280
N-(1H-indazol-5-yl)-4-(4-methanesulfonylphenyl)-2-(4-methoxyphenyl)-6-methyl-1,4-dihydropyrimidine-5-carboxamide
CID 11605996
N-(1H-indazol-5-yl)-2-(4-methoxyphenyl)-6-methyl-4-(4-sulfamoylphenyl)-1,4-dihydropyrimidine-5-carboxamide
CID 11620539
4-(4-chloro-2-fluorophenyl)-N-(1H-indazol-5-yl)-2-(4-methoxyphenyl)-6-methyl-1,4-dihydropyrimidine-5-carboxamide
CID 11641672
4-(4-chloro-2-fluorophenyl)-N-(1H-indazol-5-yl)-2-(6-methoxypyridin-3-yl)-6-methyl-1,4-dihydropyrimidine-5-carboxamide
CID 11641686
4-(4-chloro-2-fluorophenyl)-N-(1H-indazol-5-yl)-2-(2-methoxypyridin-4-yl)-6-methyl-1,4-dihydropyrimidine-5-carboxamide
CID 11663187
Dihydropyrimidine, 20
CID 25093240
4-(4-chloro-2-fluorophenyl)-N-(6-fluoro-1H-indazol-5-yl)-2-(2-methoxypyridin-4-yl)-6-methyl-1,4-dihydropyrimidine-5-carboxamide
CID 25093241
N-1H-Indazol-5-yl-4-methoxybenzamide
CID 3348038
4-ethoxy-N-(1H-indazol-5-yl)benzamide
CID 6464232
4-[4-fluoro-3-[(2-methoxyphenyl)methylcarbamoyl]phenyl]-N-(1H-indazol-5-yl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxamide
CID 118888912
4-[4-fluoro-3-[1-(2-methoxyphenyl)ethylcarbamoyl]phenyl]-N-(1H-indazol-5-yl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxamide
CID 118888914

Frequently Asked Questions

What is the IUPAC name of 4-(4-fluorophenyl)-N-(1H-indazol-5-yl)-2-(4-methoxyphenyl)-6-methyl-1,4-dihydropyrimidine-5-carboxamide?
The IUPAC name of 4-(4-fluorophenyl)-N-(1H-indazol-5-yl)-2-(4-methoxyphenyl)-6-methyl-1,4-dihydropyrimidine-5-carboxamide (CID 11590594) is 4-(4-fluorophenyl)-N-(1H-indazol-5-yl)-2-(4-methoxyphenyl)-6-methyl-1,4-dihydropyrimidine-5-carboxamide.
What is the SMILES notation for 4-(4-fluorophenyl)-N-(1H-indazol-5-yl)-2-(4-methoxyphenyl)-6-methyl-1,4-dihydropyrimidine-5-carboxamide?
The canonical SMILES for 4-(4-fluorophenyl)-N-(1H-indazol-5-yl)-2-(4-methoxyphenyl)-6-methyl-1,4-dihydropyrimidine-5-carboxamide is COc1ccc(C2=NC(c3ccc(F)cc3)C(C(=O)Nc3ccc4[nH]ncc4c3)=C(C)N2)cc1.
What is the InChIKey of 4-(4-fluorophenyl)-N-(1H-indazol-5-yl)-2-(4-methoxyphenyl)-6-methyl-1,4-dihydropyrimidine-5-carboxamide?
The InChIKey is BYZIOVDGVCHNOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H22FN5O2/c1-15-23(26(33)30-20-9-12-22-18(13-20)14-28-32-22)24(16-3-7-19(27)8-4-16)31-25(29-15)17-5-10-21(34-2)11-6-17/h3-14,24H,1-2H3,(H,28,32)(H,29,31)(H,30,33).
What are the key properties of 4-(4-fluorophenyl)-N-(1H-indazol-5-yl)-2-(4-methoxyphenyl)-6-methyl-1,4-dihydropyrimidine-5-carboxamide?
4-(4-fluorophenyl)-N-(1H-indazol-5-yl)-2-(4-methoxyphenyl)-6-methyl-1,4-dihydropyrimidine-5-carboxamide has a molecular weight of 455.49 g/mol, XLogP of 4.71, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-fluorophenyl)-N-(1H-indazol-5-yl)-2-(4-methoxyphenyl)-6-methyl-1,4-dihydropyrimidine-5-carboxamide is sourced from PubChem (CID 11590594), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).