1-(8-chloro-2-phenylimidazo[1,2-a]pyridin-3-yl)-3-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)urea;1-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)-3-(8-methyl-2-phenylimidazo[1,2-a]pyrazin-3-yl)urea;1-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)-3-[2-phenyl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]urea;1-(8-methyl-2-phenylimidazo[1,2-a]pyrazin-3-yl)-3-(2-phenyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)urea

C105H94ClF3N26O7 — CID 159181701

IUPAC1-(8-chloro-2-phenylimidazo[1,2-a]pyridin-3-yl)-3-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)urea;1-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)-3-(8-methyl-2-phenylimidazo[1,2-a]pyrazin-3-yl)urea;1-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)-3-[2-phenyl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]urea;1-(8-methyl-2-phenylimidazo[1,2-a]pyrazin-3-yl)-3-(2-phenyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)urea
SMILESCCOc1nn(-c2ccccc2)c(NC(=O)Nc2c(-c3ccccc3)nc3c(C(F)(F)F)cccn23)c1C.CCOc1nn(-c2ccccc2)c(NC(=O)Nc2c(-c3ccccc3)nc3c(C)nccn23)c1C.CCOc1nn(-c2ccccc2)c(NC(=O)Nc2c(-c3ccccc3)nc3c(Cl)cccn23)c1C.Cc1nccn2c(NC(=O)Nc3c4c(nn3-c3ccccc3)CCC4)c(-c3ccccc3)nc12
InChIInChI=1S/C27H23F3N6O2.C26H23ClN6O2.C26H25N7O2.C26H23N7O/c1-3-38-25-17(2)22(36(34-25)19-13-8-5-9-14-19)32-26(37)33-24-21(18-11-6-4-7-12-18)31-23-20(27(28,29)30)15-10-16-35(23)24;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;1-4-35-25-17(2)22(33(31-25)20-13-9-6-10-14-20)29-26(34)30-24-21(19-11-7-5-8-12-19)28-23-18(3)27-15-16-32(23)24;1-17-23-28-22(18-9-4-2-5-10-18)25(32(23)16-15-27-17)30-26(34)29-24-20-13-8-14-21(20)31-33(24)19-11-6-3-7-12-19/h4-16H,3H2,1-2H3,(H2,32,33,37);4-16H,3H2,1-2H3,(H2,29,30,34);5-16H,4H2,1-3H3,(H2,29,30,34);2-7,9-12,15-16H,8,13-14H2,1H3,(H2,29,30,34)
InChIKeyKMYZBDHUSQLTKP-UHFFFAOYSA-N
MW1924.53 g/mol
LogP23.01
Rot. Bonds22

About 1-(8-chloro-2-phenylimidazo[1,2-a]pyridin-3-yl)-3-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)urea;1-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)-3-(8-methyl-2-phenylimidazo[1,2-a]pyrazin-3-yl)urea;1-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)-3-[2-phenyl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]urea;1-(8-methyl-2-phenylimidazo[1,2-a]pyrazin-3-yl)-3-(2-phenyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)urea

1-(8-chloro-2-phenylimidazo[1,2-a]pyridin-3-yl)-3-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)urea;1-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)-3-(8-methyl-2-phenylimidazo[1,2-a]pyrazin-3-yl)urea;1-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)-3-[2-phenyl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]urea;1-(8-methyl-2-phenylimidazo[1,2-a]pyrazin-3-yl)-3-(2-phenyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)urea (PubChem CID 159181701) has the molecular formula C105H94ClF3N26O7 and a molecular weight of 1924.53 g/mol. Its IUPAC name is 1-(8-chloro-2-phenylimidazo[1,2-a]pyridin-3-yl)-3-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)urea;1-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)-3-(8-methyl-2-phenylimidazo[1,2-a]pyrazin-3-yl)urea;1-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)-3-[2-phenyl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]urea;1-(8-methyl-2-phenylimidazo[1,2-a]pyrazin-3-yl)-3-(2-phenyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)urea.

Molecular Properties

Compound Name1-(8-chloro-2-phenylimidazo[1,2-a]pyridin-3-yl)-3-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)urea;1-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)-3-(8-methyl-2-phenylimidazo[1,2-a]pyrazin-3-yl)urea;1-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)-3-[2-phenyl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]urea;1-(8-methyl-2-phenylimidazo[1,2-a]pyrazin-3-yl)-3-(2-phenyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)urea
PubChem CID159181701
Molecular FormulaC105H94ClF3N26O7
Molecular Weight1924.53 g/mol
Exact Mass1922.74
IUPAC Name1-(8-chloro-2-phenylimidazo[1,2-a]pyridin-3-yl)-3-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)urea;1-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)-3-(8-methyl-2-phenylimidazo[1,2-a]pyrazin-3-yl)urea;1-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)-3-[2-phenyl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]urea;1-(8-methyl-2-phenylimidazo[1,2-a]pyrazin-3-yl)-3-(2-phenyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)urea
SMILESCCOc1nn(-c2ccccc2)c(NC(=O)Nc2c(-c3ccccc3)nc3c(C(F)(F)F)cccn23)c1C.CCOc1nn(-c2ccccc2)c(NC(=O)Nc2c(-c3ccccc3)nc3c(C)nccn23)c1C.CCOc1nn(-c2ccccc2)c(NC(=O)Nc2c(-c3ccccc3)nc3c(Cl)cccn23)c1C.Cc1nccn2c(NC(=O)Nc3c4c(nn3-c3ccccc3)CCC4)c(-c3ccccc3)nc12
InChIInChI=1S/C27H23F3N6O2.C26H23ClN6O2.C26H25N7O2.C26H23N7O/c1-3-38-25-17(2)22(36(34-25)19-13-8-5-9-14-19)32-26(37)33-24-21(18-11-6-4-7-12-18)31-23-20(27(28,29)30)15-10-16-35(23)24;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;1-4-35-25-17(2)22(33(31-25)20-13-9-6-10-14-20)29-26(34)30-24-21(19-11-7-5-8-12-19)28-23-18(3)27-15-16-32(23)24;1-17-23-28-22(18-9-4-2-5-10-18)25(32(23)16-15-27-17)30-26(34)29-24-20-13-8-14-21(20)31-33(24)19-11-6-3-7-12-19/h4-16H,3H2,1-2H3,(H2,32,33,37);4-16H,3H2,1-2H3,(H2,29,30,34);5-16H,4H2,1-3H3,(H2,29,30,34);2-7,9-12,15-16H,8,13-14H2,1H3,(H2,29,30,34)
InChIKeyKMYZBDHUSQLTKP-UHFFFAOYSA-N
XLogP23.01
TPSA358.47 Ų
H-Bond Donors8
H-Bond Acceptors25
Rotatable Bonds22
Heavy Atoms142
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001924.53
LogP ≤ 523.01
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1025

Analyze 1-(8-chloro-2-phenylimidazo[1,2-a]pyridin-3-yl)-3-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)urea;1-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)-3-(8-methyl-2-phenylimidazo[1,2-a]pyrazin-3-yl)urea;1-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)-3-[2-phenyl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]urea;1-(8-methyl-2-phenylimidazo[1,2-a]pyrazin-3-yl)-3-(2-phenyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)urea with MolForge

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Frequently Asked Questions

What is the IUPAC name of 1-(8-chloro-2-phenylimidazo[1,2-a]pyridin-3-yl)-3-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)urea;1-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)-3-(8-methyl-2-phenylimidazo[1,2-a]pyrazin-3-yl)urea;1-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)-3-[2-phenyl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]urea;1-(8-methyl-2-phenylimidazo[1,2-a]pyrazin-3-yl)-3-(2-phenyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)urea?
The IUPAC name of 1-(8-chloro-2-phenylimidazo[1,2-a]pyridin-3-yl)-3-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)urea;1-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)-3-(8-methyl-2-phenylimidazo[1,2-a]pyrazin-3-yl)urea;1-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)-3-[2-phenyl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]urea;1-(8-methyl-2-phenylimidazo[1,2-a]pyrazin-3-yl)-3-(2-phenyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)urea (CID 159181701) is 1-(8-chloro-2-phenylimidazo[1,2-a]pyridin-3-yl)-3-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)urea;1-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)-3-(8-methyl-2-phenylimidazo[1,2-a]pyrazin-3-yl)urea;1-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)-3-[2-phenyl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]urea;1-(8-methyl-2-phenylimidazo[1,2-a]pyrazin-3-yl)-3-(2-phenyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)urea.
What is the SMILES notation for 1-(8-chloro-2-phenylimidazo[1,2-a]pyridin-3-yl)-3-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)urea;1-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)-3-(8-methyl-2-phenylimidazo[1,2-a]pyrazin-3-yl)urea;1-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)-3-[2-phenyl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]urea;1-(8-methyl-2-phenylimidazo[1,2-a]pyrazin-3-yl)-3-(2-phenyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)urea?
The canonical SMILES for 1-(8-chloro-2-phenylimidazo[1,2-a]pyridin-3-yl)-3-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)urea;1-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)-3-(8-methyl-2-phenylimidazo[1,2-a]pyrazin-3-yl)urea;1-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)-3-[2-phenyl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]urea;1-(8-methyl-2-phenylimidazo[1,2-a]pyrazin-3-yl)-3-(2-phenyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)urea is CCOc1nn(-c2ccccc2)c(NC(=O)Nc2c(-c3ccccc3)nc3c(C(F)(F)F)cccn23)c1C.CCOc1nn(-c2ccccc2)c(NC(=O)Nc2c(-c3ccccc3)nc3c(C)nccn23)c1C.CCOc1nn(-c2ccccc2)c(NC(=O)Nc2c(-c3ccccc3)nc3c(Cl)cccn23)c1C.Cc1nccn2c(NC(=O)Nc3c4c(nn3-c3ccccc3)CCC4)c(-c3ccccc3)nc12.
What is the InChIKey of 1-(8-chloro-2-phenylimidazo[1,2-a]pyridin-3-yl)-3-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)urea;1-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)-3-(8-methyl-2-phenylimidazo[1,2-a]pyrazin-3-yl)urea;1-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)-3-[2-phenyl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]urea;1-(8-methyl-2-phenylimidazo[1,2-a]pyrazin-3-yl)-3-(2-phenyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)urea?
The InChIKey is KMYZBDHUSQLTKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H23F3N6O2.C26H23ClN6O2.C26H25N7O2.C26H23N7O/c1-3-38-25-17(2)22(36(34-25)19-13-8-5-9-14-19)32-26(37)33-24-21(18-11-6-4-7-12-18)31-23-20(27(28,29)30)15-10-16-35(23)24;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;1-4-35-25-17(2)22(33(31-25)20-13-9-6-10-14-20)29-26(34)30-24-21(19-11-7-5-8-12-19)28-23-18(3)27-15-16-32(23)24;1-17-23-28-22(18-9-4-2-5-10-18)25(32(23)16-15-27-17)30-26(34)29-24-20-13-8-14-21(20)31-33(24)19-11-6-3-7-12-19/h4-16H,3H2,1-2H3,(H2,32,33,37);4-16H,3H2,1-2H3,(H2,29,30,34);5-16H,4H2,1-3H3,(H2,29,30,34);2-7,9-12,15-16H,8,13-14H2,1H3,(H2,29,30,34).
What are the key properties of 1-(8-chloro-2-phenylimidazo[1,2-a]pyridin-3-yl)-3-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)urea;1-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)-3-(8-methyl-2-phenylimidazo[1,2-a]pyrazin-3-yl)urea;1-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)-3-[2-phenyl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]urea;1-(8-methyl-2-phenylimidazo[1,2-a]pyrazin-3-yl)-3-(2-phenyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)urea?
1-(8-chloro-2-phenylimidazo[1,2-a]pyridin-3-yl)-3-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)urea;1-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)-3-(8-methyl-2-phenylimidazo[1,2-a]pyrazin-3-yl)urea;1-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)-3-[2-phenyl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]urea;1-(8-methyl-2-phenylimidazo[1,2-a]pyrazin-3-yl)-3-(2-phenyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)urea has a molecular weight of 1924.53 g/mol, XLogP of 23.01, 22 rotatable bonds, 8 hydrogen bond donors, and 25 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(8-chloro-2-phenylimidazo[1,2-a]pyridin-3-yl)-3-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)urea;1-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)-3-(8-methyl-2-phenylimidazo[1,2-a]pyrazin-3-yl)urea;1-(3-ethoxy-4-methyl-1-phenylpyrazol-5-yl)-3-[2-phenyl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]urea;1-(8-methyl-2-phenylimidazo[1,2-a]pyrazin-3-yl)-3-(2-phenyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)urea is sourced from PubChem (CID 159181701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).