ethyl 4-chloro-5-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate;ethyl 5-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate;methyl 4-chloro-5-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate;methyl 5-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate;methylsulfanylmethyl 4-chloro-5-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate;methylsulfanylmethyl 5-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate

C142H137Cl3N24O15S5 — CID 157223320

IUPACethyl 4-chloro-5-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate;ethyl 5-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate;methyl 4-chloro-5-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate;methyl 5-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate;methylsulfanylmethyl 4-chloro-5-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate;methylsulfanylmethyl 5-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate
SMILESCCOC(=O)c1cc(-c2nnc(-c3cccc(C)c3)o2)n(-c2ccccc2C(C)C)n1.CCOC(=O)c1nn(-c2ccccc2C(C)C)c(-c2nnc(-c3cccc(C)c3)s2)c1Cl.COC(=O)c1cc(-c2nnc(-c3cccc(C)c3)o2)n(-c2ccccc2C(C)C)n1.COC(=O)c1nn(-c2ccccc2C(C)C)c(-c2nnc(-c3cccc(C)c3)s2)c1Cl.CSCOC(=O)c1cc(-c2nnc(-c3cccc(C)c3)o2)n(-c2ccccc2C(C)C)n1.CSCOC(=O)c1nn(-c2ccccc2C(C)C)c(-c2nnc(-c3cccc(C)c3)s2)c1Cl
InChIInChI=1S/C24H23ClN4O2S2.C24H23ClN4O2S.C24H24N4O3S.C24H24N4O3.C23H21ClN4O2S.C23H22N4O3/c1-14(2)17-10-5-6-11-18(17)29-21(19(25)20(28-29)24(30)31-13-32-4)23-27-26-22(33-23)16-9-7-8-15(3)12-16;1-5-31-24(30)20-19(25)21(29(28-20)18-12-7-6-11-17(18)14(2)3)23-27-26-22(32-23)16-10-8-9-15(4)13-16;1-15(2)18-10-5-6-11-20(18)28-21(13-19(27-28)24(29)30-14-32-4)23-26-25-22(31-23)17-9-7-8-16(3)12-17;1-5-30-24(29)19-14-21(28(27-19)20-12-7-6-11-18(20)15(2)3)23-26-25-22(31-23)17-10-8-9-16(4)13-17;1-13(2)16-10-5-6-11-17(16)28-20(18(24)19(27-28)23(29)30-4)22-26-25-21(31-22)15-9-7-8-14(3)12-15;1-14(2)17-10-5-6-11-19(17)27-20(13-18(26-27)23(28)29-4)22-25-24-21(30-22)16-9-7-8-15(3)12-16/h5-12,14H,13H2,1-4H3;6-14H,5H2,1-4H3;5-13,15H,14H2,1-4H3;6-15H,5H2,1-4H3;5-13H,1-4H3;5-14H,1-4H3
InChIKeyATGDHIHNEKOSLZ-UHFFFAOYSA-N
MW2686.50 g/mol
LogP34.37
Rot. Bonds36

About ethyl 4-chloro-5-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate;ethyl 5-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate;methyl 4-chloro-5-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate;methyl 5-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate;methylsulfanylmethyl 4-chloro-5-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate;methylsulfanylmethyl 5-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate

ethyl 4-chloro-5-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate;ethyl 5-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate;methyl 4-chloro-5-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate;methyl 5-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate;methylsulfanylmethyl 4-chloro-5-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate;methylsulfanylmethyl 5-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate (PubChem CID 157223320) has the molecular formula C142H137Cl3N24O15S5 and a molecular weight of 2686.50 g/mol. Its IUPAC name is ethyl 4-chloro-5-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate;ethyl 5-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate;methyl 4-chloro-5-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate;methyl 5-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate;methylsulfanylmethyl 4-chloro-5-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate;methylsulfanylmethyl 5-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate.

Molecular Properties

Compound Nameethyl 4-chloro-5-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate;ethyl 5-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate;methyl 4-chloro-5-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate;methyl 5-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate;methylsulfanylmethyl 4-chloro-5-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate;methylsulfanylmethyl 5-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate
PubChem CID157223320
Molecular FormulaC142H137Cl3N24O15S5
Molecular Weight2686.50 g/mol
Exact Mass2682.84
IUPAC Nameethyl 4-chloro-5-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate;ethyl 5-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate;methyl 4-chloro-5-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate;methyl 5-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate;methylsulfanylmethyl 4-chloro-5-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate;methylsulfanylmethyl 5-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate
SMILESCCOC(=O)c1cc(-c2nnc(-c3cccc(C)c3)o2)n(-c2ccccc2C(C)C)n1.CCOC(=O)c1nn(-c2ccccc2C(C)C)c(-c2nnc(-c3cccc(C)c3)s2)c1Cl.COC(=O)c1cc(-c2nnc(-c3cccc(C)c3)o2)n(-c2ccccc2C(C)C)n1.COC(=O)c1nn(-c2ccccc2C(C)C)c(-c2nnc(-c3cccc(C)c3)s2)c1Cl.CSCOC(=O)c1cc(-c2nnc(-c3cccc(C)c3)o2)n(-c2ccccc2C(C)C)n1.CSCOC(=O)c1nn(-c2ccccc2C(C)C)c(-c2nnc(-c3cccc(C)c3)s2)c1Cl
InChIInChI=1S/C24H23ClN4O2S2.C24H23ClN4O2S.C24H24N4O3S.C24H24N4O3.C23H21ClN4O2S.C23H22N4O3/c1-14(2)17-10-5-6-11-18(17)29-21(19(25)20(28-29)24(30)31-13-32-4)23-27-26-22(33-23)16-9-7-8-15(3)12-16;1-5-31-24(30)20-19(25)21(29(28-20)18-12-7-6-11-17(18)14(2)3)23-27-26-22(32-23)16-10-8-9-15(4)13-16;1-15(2)18-10-5-6-11-20(18)28-21(13-19(27-28)24(29)30-14-32-4)23-26-25-22(31-23)17-9-7-8-16(3)12-17;1-5-30-24(29)19-14-21(28(27-19)20-12-7-6-11-18(20)15(2)3)23-26-25-22(31-23)17-10-8-9-16(4)13-17;1-13(2)16-10-5-6-11-17(16)28-20(18(24)19(27-28)23(29)30-4)22-26-25-21(31-22)15-9-7-8-14(3)12-15;1-14(2)17-10-5-6-11-19(17)27-20(13-18(26-27)23(28)29-4)22-25-24-21(30-22)16-9-7-8-15(3)12-16/h5-12,14H,13H2,1-4H3;6-14H,5H2,1-4H3;5-13,15H,14H2,1-4H3;6-15H,5H2,1-4H3;5-13H,1-4H3;5-14H,1-4H3
InChIKeyATGDHIHNEKOSLZ-UHFFFAOYSA-N
XLogP34.37
TPSA458.82 Ų
H-Bond Donors
H-Bond Acceptors44
Rotatable Bonds36
Heavy Atoms189
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002686.50
LogP ≤ 534.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1044

Computed Properties (RDKit)

Structural Alerts{'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

Analyze ethyl 4-chloro-5-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate;ethyl 5-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate;methyl 4-chloro-5-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate;methyl 5-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate;methylsulfanylmethyl 4-chloro-5-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate;methylsulfanylmethyl 5-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate with MolForge

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Frequently Asked Questions

What is the IUPAC name of ethyl 4-chloro-5-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate;ethyl 5-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate;methyl 4-chloro-5-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate;methyl 5-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate;methylsulfanylmethyl 4-chloro-5-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate;methylsulfanylmethyl 5-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate?
The IUPAC name of ethyl 4-chloro-5-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate;ethyl 5-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate;methyl 4-chloro-5-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate;methyl 5-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate;methylsulfanylmethyl 4-chloro-5-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate;methylsulfanylmethyl 5-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate (CID 157223320) is ethyl 4-chloro-5-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate;ethyl 5-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate;methyl 4-chloro-5-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate;methyl 5-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate;methylsulfanylmethyl 4-chloro-5-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate;methylsulfanylmethyl 5-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate.
What is the SMILES notation for ethyl 4-chloro-5-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate;ethyl 5-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate;methyl 4-chloro-5-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate;methyl 5-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate;methylsulfanylmethyl 4-chloro-5-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate;methylsulfanylmethyl 5-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate?
The canonical SMILES for ethyl 4-chloro-5-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate;ethyl 5-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate;methyl 4-chloro-5-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate;methyl 5-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate;methylsulfanylmethyl 4-chloro-5-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate;methylsulfanylmethyl 5-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate is CCOC(=O)c1cc(-c2nnc(-c3cccc(C)c3)o2)n(-c2ccccc2C(C)C)n1.CCOC(=O)c1nn(-c2ccccc2C(C)C)c(-c2nnc(-c3cccc(C)c3)s2)c1Cl.COC(=O)c1cc(-c2nnc(-c3cccc(C)c3)o2)n(-c2ccccc2C(C)C)n1.COC(=O)c1nn(-c2ccccc2C(C)C)c(-c2nnc(-c3cccc(C)c3)s2)c1Cl.CSCOC(=O)c1cc(-c2nnc(-c3cccc(C)c3)o2)n(-c2ccccc2C(C)C)n1.CSCOC(=O)c1nn(-c2ccccc2C(C)C)c(-c2nnc(-c3cccc(C)c3)s2)c1Cl.
What is the InChIKey of ethyl 4-chloro-5-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate;ethyl 5-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate;methyl 4-chloro-5-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate;methyl 5-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate;methylsulfanylmethyl 4-chloro-5-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate;methylsulfanylmethyl 5-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate?
The InChIKey is ATGDHIHNEKOSLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23ClN4O2S2.C24H23ClN4O2S.C24H24N4O3S.C24H24N4O3.C23H21ClN4O2S.C23H22N4O3/c1-14(2)17-10-5-6-11-18(17)29-21(19(25)20(28-29)24(30)31-13-32-4)23-27-26-22(33-23)16-9-7-8-15(3)12-16;1-5-31-24(30)20-19(25)21(29(28-20)18-12-7-6-11-17(18)14(2)3)23-27-26-22(32-23)16-10-8-9-15(4)13-16;1-15(2)18-10-5-6-11-20(18)28-21(13-19(27-28)24(29)30-14-32-4)23-26-25-22(31-23)17-9-7-8-16(3)12-17;1-5-30-24(29)19-14-21(28(27-19)20-12-7-6-11-18(20)15(2)3)23-26-25-22(31-23)17-10-8-9-16(4)13-17;1-13(2)16-10-5-6-11-17(16)28-20(18(24)19(27-28)23(29)30-4)22-26-25-21(31-22)15-9-7-8-14(3)12-15;1-14(2)17-10-5-6-11-19(17)27-20(13-18(26-27)23(28)29-4)22-25-24-21(30-22)16-9-7-8-15(3)12-16/h5-12,14H,13H2,1-4H3;6-14H,5H2,1-4H3;5-13,15H,14H2,1-4H3;6-15H,5H2,1-4H3;5-13H,1-4H3;5-14H,1-4H3.
What are the key properties of ethyl 4-chloro-5-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate;ethyl 5-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate;methyl 4-chloro-5-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate;methyl 5-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate;methylsulfanylmethyl 4-chloro-5-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate;methylsulfanylmethyl 5-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate?
ethyl 4-chloro-5-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate;ethyl 5-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate;methyl 4-chloro-5-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate;methyl 5-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate;methylsulfanylmethyl 4-chloro-5-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate;methylsulfanylmethyl 5-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate has a molecular weight of 2686.50 g/mol, XLogP of 34.37, 36 rotatable bonds, 0 hydrogen bond donors, and 44 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 4-chloro-5-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate;ethyl 5-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate;methyl 4-chloro-5-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate;methyl 5-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate;methylsulfanylmethyl 4-chloro-5-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate;methylsulfanylmethyl 5-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylate is sourced from PubChem (CID 157223320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).