1-(4,5-dimethyl-2-phenylpyrazol-3-yl)-3-(8-methyl-2-phenylimidazo[1,2-a]pyrazin-3-yl)urea;1-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)-3-(8-fluoro-2-phenylimidazo[1,2-a]pyridin-3-yl)urea;1-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)-3-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)urea;1-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)-3-(2-phenylimidazo[1,2-a]pyridin-3-yl)urea

C104H96FN25O7 — CID 157448906

IUPAC1-(4,5-dimethyl-2-phenylpyrazol-3-yl)-3-(8-methyl-2-phenylimidazo[1,2-a]pyrazin-3-yl)urea;1-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)-3-(8-fluoro-2-phenylimidazo[1,2-a]pyridin-3-yl)urea;1-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)-3-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)urea;1-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)-3-(2-phenylimidazo[1,2-a]pyridin-3-yl)urea
SMILESCCOc1nn(-c2ccccc2)c(NC(=O)Nc2c(-c3ccccc3)nc3c(C)cccn23)c1C.CCOc1nn(-c2ccccc2)c(NC(=O)Nc2c(-c3ccccc3)nc3c(F)cccn23)c1C.CCOc1nn(-c2ccccc2)c(NC(=O)Nc2c(-c3ccccc3)nc3ccccn23)c1C.Cc1nn(-c2ccccc2)c(NC(=O)Nc2c(-c3ccccc3)nc3c(C)nccn23)c1C
InChIInChI=1S/C27H26N6O2.C26H23FN6O2.C26H24N6O2.C25H23N7O/c1-4-35-26-19(3)24(33(31-26)21-15-9-6-10-16-21)29-27(34)30-25-22(20-13-7-5-8-14-20)28-23-18(2)12-11-17-32(23)25;1-3-35-25-17(2)22(33(31-25)19-13-8-5-9-14-19)29-26(34)30-24-21(18-11-6-4-7-12-18)28-23-20(27)15-10-16-32(23)24;1-3-34-25-18(2)23(32(30-25)20-14-8-5-9-15-20)28-26(33)29-24-22(19-12-6-4-7-13-19)27-21-16-10-11-17-31(21)24;1-16-17(2)30-32(20-12-8-5-9-13-20)22(16)28-25(33)29-24-21(19-10-6-4-7-11-19)27-23-18(3)26-14-15-31(23)24/h5-17H,4H2,1-3H3,(H2,29,30,34);4-16H,3H2,1-2H3,(H2,29,30,34);4-17H,3H2,1-2H3,(H2,28,29,33);4-15H,1-3H3,(H2,28,29,33)
InChIKeyBSOFASVOPYYGNM-UHFFFAOYSA-N
MW1827.08 g/mol
LogP22.21
Rot. Bonds22

About 1-(4,5-dimethyl-2-phenylpyrazol-3-yl)-3-(8-methyl-2-phenylimidazo[1,2-a]pyrazin-3-yl)urea;1-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)-3-(8-fluoro-2-phenylimidazo[1,2-a]pyridin-3-yl)urea;1-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)-3-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)urea;1-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)-3-(2-phenylimidazo[1,2-a]pyridin-3-yl)urea

1-(4,5-dimethyl-2-phenylpyrazol-3-yl)-3-(8-methyl-2-phenylimidazo[1,2-a]pyrazin-3-yl)urea;1-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)-3-(8-fluoro-2-phenylimidazo[1,2-a]pyridin-3-yl)urea;1-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)-3-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)urea;1-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)-3-(2-phenylimidazo[1,2-a]pyridin-3-yl)urea (PubChem CID 157448906) has the molecular formula C104H96FN25O7 and a molecular weight of 1827.08 g/mol. Its IUPAC name is 1-(4,5-dimethyl-2-phenylpyrazol-3-yl)-3-(8-methyl-2-phenylimidazo[1,2-a]pyrazin-3-yl)urea;1-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)-3-(8-fluoro-2-phenylimidazo[1,2-a]pyridin-3-yl)urea;1-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)-3-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)urea;1-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)-3-(2-phenylimidazo[1,2-a]pyridin-3-yl)urea.

Molecular Properties

Compound Name1-(4,5-dimethyl-2-phenylpyrazol-3-yl)-3-(8-methyl-2-phenylimidazo[1,2-a]pyrazin-3-yl)urea;1-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)-3-(8-fluoro-2-phenylimidazo[1,2-a]pyridin-3-yl)urea;1-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)-3-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)urea;1-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)-3-(2-phenylimidazo[1,2-a]pyridin-3-yl)urea
PubChem CID157448906
Molecular FormulaC104H96FN25O7
Molecular Weight1827.08 g/mol
Exact Mass1825.79
IUPAC Name1-(4,5-dimethyl-2-phenylpyrazol-3-yl)-3-(8-methyl-2-phenylimidazo[1,2-a]pyrazin-3-yl)urea;1-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)-3-(8-fluoro-2-phenylimidazo[1,2-a]pyridin-3-yl)urea;1-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)-3-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)urea;1-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)-3-(2-phenylimidazo[1,2-a]pyridin-3-yl)urea
SMILESCCOc1nn(-c2ccccc2)c(NC(=O)Nc2c(-c3ccccc3)nc3c(C)cccn23)c1C.CCOc1nn(-c2ccccc2)c(NC(=O)Nc2c(-c3ccccc3)nc3c(F)cccn23)c1C.CCOc1nn(-c2ccccc2)c(NC(=O)Nc2c(-c3ccccc3)nc3ccccn23)c1C.Cc1nn(-c2ccccc2)c(NC(=O)Nc2c(-c3ccccc3)nc3c(C)nccn23)c1C
InChIInChI=1S/C27H26N6O2.C26H23FN6O2.C26H24N6O2.C25H23N7O/c1-4-35-26-19(3)24(33(31-26)21-15-9-6-10-16-21)29-27(34)30-25-22(20-13-7-5-8-14-20)28-23-18(2)12-11-17-32(23)25;1-3-35-25-17(2)22(33(31-25)19-13-8-5-9-14-19)29-26(34)30-24-21(18-11-6-4-7-12-18)28-23-20(27)15-10-16-32(23)24;1-3-34-25-18(2)23(32(30-25)20-14-8-5-9-15-20)28-26(33)29-24-22(19-12-6-4-7-13-19)27-21-16-10-11-17-31(21)24;1-16-17(2)30-32(20-12-8-5-9-13-20)22(16)28-25(33)29-24-21(19-10-6-4-7-11-19)27-23-18(3)26-14-15-31(23)24/h5-17H,4H2,1-3H3,(H2,29,30,34);4-16H,3H2,1-2H3,(H2,29,30,34);4-17H,3H2,1-2H3,(H2,28,29,33);4-15H,1-3H3,(H2,28,29,33)
InChIKeyBSOFASVOPYYGNM-UHFFFAOYSA-N
XLogP22.21
TPSA345.58 Ų
H-Bond Donors8
H-Bond Acceptors24
Rotatable Bonds22
Heavy Atoms137
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001827.08
LogP ≤ 522.21
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1024

Analyze 1-(4,5-dimethyl-2-phenylpyrazol-3-yl)-3-(8-methyl-2-phenylimidazo[1,2-a]pyrazin-3-yl)urea;1-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)-3-(8-fluoro-2-phenylimidazo[1,2-a]pyridin-3-yl)urea;1-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)-3-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)urea;1-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)-3-(2-phenylimidazo[1,2-a]pyridin-3-yl)urea with MolForge

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Related Compounds

1-(5-Ethoxy-4-methyl-2-phenylpyrazol-3-yl)-3-[2-(4-fluorophenyl)-8-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]urea
CID 74766768
1-[5-[(2R)-2-hydroxy-3-methoxypropoxy]-4-methyl-2-phenylpyrazol-3-yl]-3-[2-phenyl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]urea
CID 74766841
1-[5-[(2S)-2-hydroxy-3-methoxypropoxy]-4-methyl-2-phenylpyrazol-3-yl]-3-[2-phenyl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]urea
CID 74766842
1-[5-(2-Hydroxy-2-methylpropoxy)-4-methyl-2-phenylpyrazol-3-yl]-3-[2-phenyl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]urea
CID 74766919
1-[5-[(2R)-2-hydroxypropoxy]-4-methyl-2-phenylpyrazol-3-yl]-3-[2-phenyl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]urea
CID 74766920
1-(5-Ethoxy-4-methyl-2-phenylpyrazol-3-yl)-3-[2-phenyl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]urea
CID 74766997
1-(3-Ethoxy-4-methyl-1-phenylpyrazol-5-yl)-3-(8-fluoro-2-phenylimidazo[1,2-a]pyridin-3-yl)urea
CID 74767000
1-(5-Methoxy-4-methyl-2-phenylpyrazol-3-yl)-3-[2-phenyl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]urea
CID 74767248
1-[5-[3-Hydroxy-2-(hydroxymethyl)propoxy]-4-methyl-2-phenylpyrazol-3-yl]-3-[2-phenyl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]urea
CID 74767324
1-(5-Ethoxy-4-methyl-2-phenylpyrazol-3-yl)-3-[2-(3-fluorophenyl)-8-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]urea
CID 90156351
1-[5-[(2R)-2-[tert-butyl(dimethyl)silyl]oxy-3-methoxypropoxy]-4-methyl-2-phenylpyrazol-3-yl]-3-[2-phenyl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]urea
CID 90156363
1-[3-[2-[Tert-butyl(dimethyl)silyl]oxy-3-methoxypropoxy]-4-methyl-1-phenylpyrazol-5-yl]-3-[2-phenyl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]urea
CID 90156365

Frequently Asked Questions

What is the IUPAC name of 1-(4,5-dimethyl-2-phenylpyrazol-3-yl)-3-(8-methyl-2-phenylimidazo[1,2-a]pyrazin-3-yl)urea;1-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)-3-(8-fluoro-2-phenylimidazo[1,2-a]pyridin-3-yl)urea;1-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)-3-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)urea;1-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)-3-(2-phenylimidazo[1,2-a]pyridin-3-yl)urea?
The IUPAC name of 1-(4,5-dimethyl-2-phenylpyrazol-3-yl)-3-(8-methyl-2-phenylimidazo[1,2-a]pyrazin-3-yl)urea;1-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)-3-(8-fluoro-2-phenylimidazo[1,2-a]pyridin-3-yl)urea;1-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)-3-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)urea;1-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)-3-(2-phenylimidazo[1,2-a]pyridin-3-yl)urea (CID 157448906) is 1-(4,5-dimethyl-2-phenylpyrazol-3-yl)-3-(8-methyl-2-phenylimidazo[1,2-a]pyrazin-3-yl)urea;1-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)-3-(8-fluoro-2-phenylimidazo[1,2-a]pyridin-3-yl)urea;1-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)-3-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)urea;1-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)-3-(2-phenylimidazo[1,2-a]pyridin-3-yl)urea.
What is the SMILES notation for 1-(4,5-dimethyl-2-phenylpyrazol-3-yl)-3-(8-methyl-2-phenylimidazo[1,2-a]pyrazin-3-yl)urea;1-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)-3-(8-fluoro-2-phenylimidazo[1,2-a]pyridin-3-yl)urea;1-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)-3-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)urea;1-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)-3-(2-phenylimidazo[1,2-a]pyridin-3-yl)urea?
The canonical SMILES for 1-(4,5-dimethyl-2-phenylpyrazol-3-yl)-3-(8-methyl-2-phenylimidazo[1,2-a]pyrazin-3-yl)urea;1-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)-3-(8-fluoro-2-phenylimidazo[1,2-a]pyridin-3-yl)urea;1-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)-3-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)urea;1-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)-3-(2-phenylimidazo[1,2-a]pyridin-3-yl)urea is CCOc1nn(-c2ccccc2)c(NC(=O)Nc2c(-c3ccccc3)nc3c(C)cccn23)c1C.CCOc1nn(-c2ccccc2)c(NC(=O)Nc2c(-c3ccccc3)nc3c(F)cccn23)c1C.CCOc1nn(-c2ccccc2)c(NC(=O)Nc2c(-c3ccccc3)nc3ccccn23)c1C.Cc1nn(-c2ccccc2)c(NC(=O)Nc2c(-c3ccccc3)nc3c(C)nccn23)c1C.
What is the InChIKey of 1-(4,5-dimethyl-2-phenylpyrazol-3-yl)-3-(8-methyl-2-phenylimidazo[1,2-a]pyrazin-3-yl)urea;1-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)-3-(8-fluoro-2-phenylimidazo[1,2-a]pyridin-3-yl)urea;1-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)-3-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)urea;1-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)-3-(2-phenylimidazo[1,2-a]pyridin-3-yl)urea?
The InChIKey is BSOFASVOPYYGNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H26N6O2.C26H23FN6O2.C26H24N6O2.C25H23N7O/c1-4-35-26-19(3)24(33(31-26)21-15-9-6-10-16-21)29-27(34)30-25-22(20-13-7-5-8-14-20)28-23-18(2)12-11-17-32(23)25;1-3-35-25-17(2)22(33(31-25)19-13-8-5-9-14-19)29-26(34)30-24-21(18-11-6-4-7-12-18)28-23-20(27)15-10-16-32(23)24;1-3-34-25-18(2)23(32(30-25)20-14-8-5-9-15-20)28-26(33)29-24-22(19-12-6-4-7-13-19)27-21-16-10-11-17-31(21)24;1-16-17(2)30-32(20-12-8-5-9-13-20)22(16)28-25(33)29-24-21(19-10-6-4-7-11-19)27-23-18(3)26-14-15-31(23)24/h5-17H,4H2,1-3H3,(H2,29,30,34);4-16H,3H2,1-2H3,(H2,29,30,34);4-17H,3H2,1-2H3,(H2,28,29,33);4-15H,1-3H3,(H2,28,29,33).
What are the key properties of 1-(4,5-dimethyl-2-phenylpyrazol-3-yl)-3-(8-methyl-2-phenylimidazo[1,2-a]pyrazin-3-yl)urea;1-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)-3-(8-fluoro-2-phenylimidazo[1,2-a]pyridin-3-yl)urea;1-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)-3-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)urea;1-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)-3-(2-phenylimidazo[1,2-a]pyridin-3-yl)urea?
1-(4,5-dimethyl-2-phenylpyrazol-3-yl)-3-(8-methyl-2-phenylimidazo[1,2-a]pyrazin-3-yl)urea;1-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)-3-(8-fluoro-2-phenylimidazo[1,2-a]pyridin-3-yl)urea;1-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)-3-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)urea;1-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)-3-(2-phenylimidazo[1,2-a]pyridin-3-yl)urea has a molecular weight of 1827.08 g/mol, XLogP of 22.21, 22 rotatable bonds, 8 hydrogen bond donors, and 24 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4,5-dimethyl-2-phenylpyrazol-3-yl)-3-(8-methyl-2-phenylimidazo[1,2-a]pyrazin-3-yl)urea;1-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)-3-(8-fluoro-2-phenylimidazo[1,2-a]pyridin-3-yl)urea;1-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)-3-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)urea;1-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)-3-(2-phenylimidazo[1,2-a]pyridin-3-yl)urea is sourced from PubChem (CID 157448906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).