N-[4-[3-(4-fluorophenyl)-1-methylpyrazol-4-yl]-7-methoxyquinazolin-6-yl]-4-methyl-1,3-thiazole-5-carboxamide

C24H19FN6O2S — CID 169230931

IUPACN-[4-[3-(4-fluorophenyl)-1-methylpyrazol-4-yl]-7-methoxyquinazolin-6-yl]-4-methyl-1,3-thiazole-5-carboxamide
SMILESCOc1cc2ncnc(-c3cn(C)nc3-c3ccc(F)cc3)c2cc1NC(=O)c1scnc1C
InChIInChI=1S/C24H19FN6O2S/c1-13-23(34-12-28-13)24(32)29-19-8-16-18(9-20(19)33-3)26-11-27-22(16)17-10-31(2)30-21(17)14-4-6-15(25)7-5-14/h4-12H,1-3H3,(H,29,32)
InChIKeyBDUUJPASRFBBRH-UHFFFAOYSA-N
MW474.52 g/mol
LogP4.86
Rot. Bonds5

About N-[4-[3-(4-fluorophenyl)-1-methylpyrazol-4-yl]-7-methoxyquinazolin-6-yl]-4-methyl-1,3-thiazole-5-carboxamide

N-[4-[3-(4-fluorophenyl)-1-methylpyrazol-4-yl]-7-methoxyquinazolin-6-yl]-4-methyl-1,3-thiazole-5-carboxamide (PubChem CID 169230931) has the molecular formula C24H19FN6O2S and a molecular weight of 474.52 g/mol. Its IUPAC name is N-[4-[3-(4-fluorophenyl)-1-methylpyrazol-4-yl]-7-methoxyquinazolin-6-yl]-4-methyl-1,3-thiazole-5-carboxamide.

Molecular Properties

Compound NameN-[4-[3-(4-fluorophenyl)-1-methylpyrazol-4-yl]-7-methoxyquinazolin-6-yl]-4-methyl-1,3-thiazole-5-carboxamide
PubChem CID169230931
Molecular FormulaC24H19FN6O2S
Molecular Weight474.52 g/mol
Exact Mass474.13
IUPAC NameN-[4-[3-(4-fluorophenyl)-1-methylpyrazol-4-yl]-7-methoxyquinazolin-6-yl]-4-methyl-1,3-thiazole-5-carboxamide
SMILESCOc1cc2ncnc(-c3cn(C)nc3-c3ccc(F)cc3)c2cc1NC(=O)c1scnc1C
InChIInChI=1S/C24H19FN6O2S/c1-13-23(34-12-28-13)24(32)29-19-8-16-18(9-20(19)33-3)26-11-27-22(16)17-10-31(2)30-21(17)14-4-6-15(25)7-5-14/h4-12H,1-3H3,(H,29,32)
InChIKeyBDUUJPASRFBBRH-UHFFFAOYSA-N
XLogP4.86
TPSA94.82 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500474.52
LogP ≤ 54.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

Analyze N-[4-[3-(4-fluorophenyl)-1-methylpyrazol-4-yl]-7-methoxyquinazolin-6-yl]-4-methyl-1,3-thiazole-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

(R)-N,N-dimethyl-2-(4-(1-(thiazol-4-ylmethyl)-1H-indazol-5-ylamino)quinazolin-5-yloxy)propanamide
CID 16117347
(R)-2-(4-(1-(thiazol-4-ylmethyl)-1H-indazol-5-ylamino)quinazolin-5-yloxy)propanamide
CID 16117758
(S)-N,N-dimethyl-2-(4-(1-(thiazol-4-ylmethyl)-1H-indazol-5-ylamino)quinazolin-5-yloxy)propanamide
CID 16117891
N-(7-methoxyquinolin-6-yl)thieno[3,2-d]pyrimidine-7-carboxamide
CID 58056356
2-(3-aminopropylamino)-N-(7-methoxyquinolin-6-yl)thieno[3,2-d]pyrimidine-7-carboxamide
CID 58056089
2-(2-aminoethylamino)-N-(7-methoxyquinolin-6-yl)thieno[3,2-d]pyrimidine-7-carboxamide
CID 58056111
N-(7-methoxyquinolin-6-yl)-2-(2-methylpropylamino)thieno[3,2-d]pyrimidine-7-carboxamide
CID 58056228
N-(7-pyrrolidin-3-yloxyquinolin-6-yl)thieno[3,2-d]pyrimidine-7-carboxamide
CID 58056278
N-(7-methoxyquinolin-6-yl)-2-[methyl(propan-2-yl)amino]thieno[3,2-d]pyrimidine-7-carboxamide
CID 58056358
N-[4-(4-fluorophenyl)-5-[2-[2-methoxy-5-(1-methylpyrazol-4-yl)-4-morpholin-4-ylanilino]pyrimidin-4-yl]-1,3-thiazol-2-yl]ethanesulfonamide
CID 168867741
US20250236608, Example 333
CID 169230934
US20250236608, Example 292
CID 169230964

Frequently Asked Questions

What is the IUPAC name of N-[4-[3-(4-fluorophenyl)-1-methylpyrazol-4-yl]-7-methoxyquinazolin-6-yl]-4-methyl-1,3-thiazole-5-carboxamide?
The IUPAC name of N-[4-[3-(4-fluorophenyl)-1-methylpyrazol-4-yl]-7-methoxyquinazolin-6-yl]-4-methyl-1,3-thiazole-5-carboxamide (CID 169230931) is N-[4-[3-(4-fluorophenyl)-1-methylpyrazol-4-yl]-7-methoxyquinazolin-6-yl]-4-methyl-1,3-thiazole-5-carboxamide.
What is the SMILES notation for N-[4-[3-(4-fluorophenyl)-1-methylpyrazol-4-yl]-7-methoxyquinazolin-6-yl]-4-methyl-1,3-thiazole-5-carboxamide?
The canonical SMILES for N-[4-[3-(4-fluorophenyl)-1-methylpyrazol-4-yl]-7-methoxyquinazolin-6-yl]-4-methyl-1,3-thiazole-5-carboxamide is COc1cc2ncnc(-c3cn(C)nc3-c3ccc(F)cc3)c2cc1NC(=O)c1scnc1C.
What is the InChIKey of N-[4-[3-(4-fluorophenyl)-1-methylpyrazol-4-yl]-7-methoxyquinazolin-6-yl]-4-methyl-1,3-thiazole-5-carboxamide?
The InChIKey is BDUUJPASRFBBRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H19FN6O2S/c1-13-23(34-12-28-13)24(32)29-19-8-16-18(9-20(19)33-3)26-11-27-22(16)17-10-31(2)30-21(17)14-4-6-15(25)7-5-14/h4-12H,1-3H3,(H,29,32).
What are the key properties of N-[4-[3-(4-fluorophenyl)-1-methylpyrazol-4-yl]-7-methoxyquinazolin-6-yl]-4-methyl-1,3-thiazole-5-carboxamide?
N-[4-[3-(4-fluorophenyl)-1-methylpyrazol-4-yl]-7-methoxyquinazolin-6-yl]-4-methyl-1,3-thiazole-5-carboxamide has a molecular weight of 474.52 g/mol, XLogP of 4.86, 5 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[3-(4-fluorophenyl)-1-methylpyrazol-4-yl]-7-methoxyquinazolin-6-yl]-4-methyl-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 169230931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).