(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[(6-methyl-3-pyridinyl)methyl]pyrimidin-4-yl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[[3-(2-morpholin-4-ylethoxy)phenyl]methyl]-4-pyridinyl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[[4-(2-morpholin-4-ylethoxy)phenyl]methyl]pyrimidin-4-yl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]methyl]pyrimidin-4-yl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[(3-morpholin-4-ylphenyl)methyl]pyrimidin-4-yl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[(4-morpholin-4-ylphenyl)methyl]pyrimidin-4-yl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[(6-morpholin-4-yl-3-pyridinyl)methyl]pyrimidin-4-yl]carbamate;[2-methyl-5-[2-oxo-2-[3-(trifluoromethyl)phenyl]ethyl]phenyl] N-(7H-cyclopenta[d]pyrimidin-4-yl)-N-methylcarbamate

C248H262F3N33O39 — CID 161234363

IUPAC(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[(6-methyl-3-pyridinyl)methyl]pyrimidin-4-yl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[[3-(2-morpholin-4-ylethoxy)phenyl]methyl]-4-pyridinyl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[[4-(2-morpholin-4-ylethoxy)phenyl]methyl]pyrimidin-4-yl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]methyl]pyrimidin-4-yl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[(3-morpholin-4-ylphenyl)methyl]pyrimidin-4-yl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[(4-morpholin-4-ylphenyl)methyl]pyrimidin-4-yl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[(6-morpholin-4-yl-3-pyridinyl)methyl]pyrimidin-4-yl]carbamate;[2-methyl-5-[2-oxo-2-[3-(trifluoromethyl)phenyl]ethyl]phenyl] N-(7H-cyclopenta[d]pyrimidin-4-yl)-N-methylcarbamate
SMILESCOc1ccc(N(C(=O)Oc2c(C)cccc2C)c2ccnc(Cc3ccc(C)nc3)n2)c(OC)c1.COc1ccc(N(C(=O)Oc2c(C)cccc2C)c2ccnc(Cc3ccc(N4CCOCC4)cc3)n2)c(OC)c1.COc1ccc(N(C(=O)Oc2c(C)cccc2C)c2ccnc(Cc3ccc(N4CCOCC4)nc3)n2)c(OC)c1.COc1ccc(N(C(=O)Oc2c(C)cccc2C)c2ccnc(Cc3ccc(OCCN4CCOCC4)cc3)n2)c(OC)c1.COc1ccc(N(C(=O)Oc2c(C)cccc2C)c2ccnc(Cc3cccc(N4CCOCC4)c3)n2)c(OC)c1.COc1ccc(N(C(=O)Oc2c(C)cccc2C)c2ccnc(Cc3cccc(OCCN4CCOCC4)c3)c2)c(OC)c1.COc1ccc(N(C(=O)Oc2c(C)cccc2C)c2ccnc(Cc3cnn(CCN4CCOCC4)c3)n2)c(OC)c1.Cc1ccc(CC(=O)c2cccc(C(F)(F)F)c2)cc1OC(=O)N(C)c1ncnc2c1C=CC2
InChIInChI=1S/C35H39N3O6.C34H38N4O6.2C32H34N4O5.C31H36N6O5.C31H33N5O5.C28H28N4O4.C25H20F3N3O3/c1-25-7-5-8-26(2)34(25)44-35(39)38(32-12-11-30(40-3)24-33(32)41-4)29-13-14-36-28(23-29)21-27-9-6-10-31(22-27)43-20-17-37-15-18-42-19-16-37;1-24-6-5-7-25(2)33(24)44-34(39)38(29-13-12-28(40-3)23-30(29)41-4)32-14-15-35-31(36-32)22-26-8-10-27(11-9-26)43-21-18-37-16-19-42-20-17-37;1-22-7-5-8-23(2)31(22)41-32(37)36(27-12-11-26(38-3)21-28(27)39-4)30-13-14-33-29(34-30)20-24-9-6-10-25(19-24)35-15-17-40-18-16-35;1-22-6-5-7-23(2)31(22)41-32(37)36(27-13-12-26(38-3)21-28(27)39-4)30-14-15-33-29(34-30)20-24-8-10-25(11-9-24)35-16-18-40-19-17-35;1-22-6-5-7-23(2)30(22)42-31(38)37(26-9-8-25(39-3)19-27(26)40-4)29-10-11-32-28(34-29)18-24-20-33-36(21-24)13-12-35-14-16-41-17-15-35;1-21-6-5-7-22(2)30(21)41-31(37)36(25-10-9-24(38-3)19-26(25)39-4)29-12-13-32-27(34-29)18-23-8-11-28(33-20-23)35-14-16-40-17-15-35;1-18-7-6-8-19(2)27(18)36-28(33)32(23-12-11-22(34-4)16-24(23)35-5)26-13-14-29-25(31-26)15-21-10-9-20(3)30-17-21;1-15-9-10-16(11-21(32)17-5-3-6-18(13-17)25(26,27)28)12-22(15)34-24(33)31(2)23-19-7-4-8-20(19)29-14-30-23/h5-14,22-24H,15-21H2,1-4H3;5-15,23H,16-22H2,1-4H3;5-14,19,21H,15-18,20H2,1-4H3;5-15,21H,16-20H2,1-4H3;5-11,19-21H,12-18H2,1-4H3;5-13,19-20H,14-18H2,1-4H3;6-14,16-17H,15H2,1-5H3;3-7,9-10,12-14H,8,11H2,1-2H3
InChIKeyUZEFAWAQLHHABQ-UHFFFAOYSA-N
MW4386.01 g/mol
LogP44.87
Rot. Bonds68

About (2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[(6-methyl-3-pyridinyl)methyl]pyrimidin-4-yl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[[3-(2-morpholin-4-ylethoxy)phenyl]methyl]-4-pyridinyl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[[4-(2-morpholin-4-ylethoxy)phenyl]methyl]pyrimidin-4-yl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]methyl]pyrimidin-4-yl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[(3-morpholin-4-ylphenyl)methyl]pyrimidin-4-yl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[(4-morpholin-4-ylphenyl)methyl]pyrimidin-4-yl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[(6-morpholin-4-yl-3-pyridinyl)methyl]pyrimidin-4-yl]carbamate;[2-methyl-5-[2-oxo-2-[3-(trifluoromethyl)phenyl]ethyl]phenyl] N-(7H-cyclopenta[d]pyrimidin-4-yl)-N-methylcarbamate

(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[(6-methyl-3-pyridinyl)methyl]pyrimidin-4-yl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[[3-(2-morpholin-4-ylethoxy)phenyl]methyl]-4-pyridinyl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[[4-(2-morpholin-4-ylethoxy)phenyl]methyl]pyrimidin-4-yl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]methyl]pyrimidin-4-yl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[(3-morpholin-4-ylphenyl)methyl]pyrimidin-4-yl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[(4-morpholin-4-ylphenyl)methyl]pyrimidin-4-yl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[(6-morpholin-4-yl-3-pyridinyl)methyl]pyrimidin-4-yl]carbamate;[2-methyl-5-[2-oxo-2-[3-(trifluoromethyl)phenyl]ethyl]phenyl] N-(7H-cyclopenta[d]pyrimidin-4-yl)-N-methylcarbamate (PubChem CID 161234363) has the molecular formula C248H262F3N33O39 and a molecular weight of 4386.01 g/mol. Its IUPAC name is (2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[(6-methyl-3-pyridinyl)methyl]pyrimidin-4-yl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[[3-(2-morpholin-4-ylethoxy)phenyl]methyl]-4-pyridinyl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[[4-(2-morpholin-4-ylethoxy)phenyl]methyl]pyrimidin-4-yl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]methyl]pyrimidin-4-yl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[(3-morpholin-4-ylphenyl)methyl]pyrimidin-4-yl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[(4-morpholin-4-ylphenyl)methyl]pyrimidin-4-yl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[(6-morpholin-4-yl-3-pyridinyl)methyl]pyrimidin-4-yl]carbamate;[2-methyl-5-[2-oxo-2-[3-(trifluoromethyl)phenyl]ethyl]phenyl] N-(7H-cyclopenta[d]pyrimidin-4-yl)-N-methylcarbamate.

Molecular Properties

Compound Name(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[(6-methyl-3-pyridinyl)methyl]pyrimidin-4-yl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[[3-(2-morpholin-4-ylethoxy)phenyl]methyl]-4-pyridinyl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[[4-(2-morpholin-4-ylethoxy)phenyl]methyl]pyrimidin-4-yl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]methyl]pyrimidin-4-yl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[(3-morpholin-4-ylphenyl)methyl]pyrimidin-4-yl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[(4-morpholin-4-ylphenyl)methyl]pyrimidin-4-yl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[(6-morpholin-4-yl-3-pyridinyl)methyl]pyrimidin-4-yl]carbamate;[2-methyl-5-[2-oxo-2-[3-(trifluoromethyl)phenyl]ethyl]phenyl] N-(7H-cyclopenta[d]pyrimidin-4-yl)-N-methylcarbamate
PubChem CID161234363
Molecular FormulaC248H262F3N33O39
Molecular Weight4386.01 g/mol
Exact Mass4382.95
IUPAC Name(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[(6-methyl-3-pyridinyl)methyl]pyrimidin-4-yl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[[3-(2-morpholin-4-ylethoxy)phenyl]methyl]-4-pyridinyl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[[4-(2-morpholin-4-ylethoxy)phenyl]methyl]pyrimidin-4-yl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]methyl]pyrimidin-4-yl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[(3-morpholin-4-ylphenyl)methyl]pyrimidin-4-yl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[(4-morpholin-4-ylphenyl)methyl]pyrimidin-4-yl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[(6-morpholin-4-yl-3-pyridinyl)methyl]pyrimidin-4-yl]carbamate;[2-methyl-5-[2-oxo-2-[3-(trifluoromethyl)phenyl]ethyl]phenyl] N-(7H-cyclopenta[d]pyrimidin-4-yl)-N-methylcarbamate
SMILESCOc1ccc(N(C(=O)Oc2c(C)cccc2C)c2ccnc(Cc3ccc(C)nc3)n2)c(OC)c1.COc1ccc(N(C(=O)Oc2c(C)cccc2C)c2ccnc(Cc3ccc(N4CCOCC4)cc3)n2)c(OC)c1.COc1ccc(N(C(=O)Oc2c(C)cccc2C)c2ccnc(Cc3ccc(N4CCOCC4)nc3)n2)c(OC)c1.COc1ccc(N(C(=O)Oc2c(C)cccc2C)c2ccnc(Cc3ccc(OCCN4CCOCC4)cc3)n2)c(OC)c1.COc1ccc(N(C(=O)Oc2c(C)cccc2C)c2ccnc(Cc3cccc(N4CCOCC4)c3)n2)c(OC)c1.COc1ccc(N(C(=O)Oc2c(C)cccc2C)c2ccnc(Cc3cccc(OCCN4CCOCC4)c3)c2)c(OC)c1.COc1ccc(N(C(=O)Oc2c(C)cccc2C)c2ccnc(Cc3cnn(CCN4CCOCC4)c3)n2)c(OC)c1.Cc1ccc(CC(=O)c2cccc(C(F)(F)F)c2)cc1OC(=O)N(C)c1ncnc2c1C=CC2
InChIInChI=1S/C35H39N3O6.C34H38N4O6.2C32H34N4O5.C31H36N6O5.C31H33N5O5.C28H28N4O4.C25H20F3N3O3/c1-25-7-5-8-26(2)34(25)44-35(39)38(32-12-11-30(40-3)24-33(32)41-4)29-13-14-36-28(23-29)21-27-9-6-10-31(22-27)43-20-17-37-15-18-42-19-16-37;1-24-6-5-7-25(2)33(24)44-34(39)38(29-13-12-28(40-3)23-30(29)41-4)32-14-15-35-31(36-32)22-26-8-10-27(11-9-26)43-21-18-37-16-19-42-20-17-37;1-22-7-5-8-23(2)31(22)41-32(37)36(27-12-11-26(38-3)21-28(27)39-4)30-13-14-33-29(34-30)20-24-9-6-10-25(19-24)35-15-17-40-18-16-35;1-22-6-5-7-23(2)31(22)41-32(37)36(27-13-12-26(38-3)21-28(27)39-4)30-14-15-33-29(34-30)20-24-8-10-25(11-9-24)35-16-18-40-19-17-35;1-22-6-5-7-23(2)30(22)42-31(38)37(26-9-8-25(39-3)19-27(26)40-4)29-10-11-32-28(34-29)18-24-20-33-36(21-24)13-12-35-14-16-41-17-15-35;1-21-6-5-7-22(2)30(21)41-31(37)36(25-10-9-24(38-3)19-26(25)39-4)29-12-13-32-27(34-29)18-23-8-11-28(33-20-23)35-14-16-40-17-15-35;1-18-7-6-8-19(2)27(18)36-28(33)32(23-12-11-22(34-4)16-24(23)35-5)26-13-14-29-25(31-26)15-21-10-9-20(3)30-17-21;1-15-9-10-16(11-21(32)17-5-3-6-18(13-17)25(26,27)28)12-22(15)34-24(33)31(2)23-19-7-4-8-20(19)29-14-30-23/h5-14,22-24H,15-21H2,1-4H3;5-15,23H,16-22H2,1-4H3;5-14,19,21H,15-18,20H2,1-4H3;5-15,21H,16-20H2,1-4H3;5-11,19-21H,12-18H2,1-4H3;5-13,19-20H,14-18H2,1-4H3;6-14,16-17H,15H2,1-5H3;3-7,9-10,12-14H,8,11H2,1-2H3
InChIKeyUZEFAWAQLHHABQ-UHFFFAOYSA-N
XLogP44.87
TPSA712.84 Ų
H-Bond Donors
H-Bond Acceptors64
Rotatable Bonds68
Heavy Atoms323
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004386.01
LogP ≤ 544.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1064

Analyze (2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[(6-methyl-3-pyridinyl)methyl]pyrimidin-4-yl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[[3-(2-morpholin-4-ylethoxy)phenyl]methyl]-4-pyridinyl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[[4-(2-morpholin-4-ylethoxy)phenyl]methyl]pyrimidin-4-yl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]methyl]pyrimidin-4-yl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[(3-morpholin-4-ylphenyl)methyl]pyrimidin-4-yl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[(4-morpholin-4-ylphenyl)methyl]pyrimidin-4-yl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[(6-morpholin-4-yl-3-pyridinyl)methyl]pyrimidin-4-yl]carbamate;[2-methyl-5-[2-oxo-2-[3-(trifluoromethyl)phenyl]ethyl]phenyl] N-(7H-cyclopenta[d]pyrimidin-4-yl)-N-methylcarbamate with MolForge

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Frequently Asked Questions

What is the IUPAC name of (2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[(6-methyl-3-pyridinyl)methyl]pyrimidin-4-yl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[[3-(2-morpholin-4-ylethoxy)phenyl]methyl]-4-pyridinyl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[[4-(2-morpholin-4-ylethoxy)phenyl]methyl]pyrimidin-4-yl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]methyl]pyrimidin-4-yl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[(3-morpholin-4-ylphenyl)methyl]pyrimidin-4-yl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[(4-morpholin-4-ylphenyl)methyl]pyrimidin-4-yl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[(6-morpholin-4-yl-3-pyridinyl)methyl]pyrimidin-4-yl]carbamate;[2-methyl-5-[2-oxo-2-[3-(trifluoromethyl)phenyl]ethyl]phenyl] N-(7H-cyclopenta[d]pyrimidin-4-yl)-N-methylcarbamate?
The IUPAC name of (2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[(6-methyl-3-pyridinyl)methyl]pyrimidin-4-yl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[[3-(2-morpholin-4-ylethoxy)phenyl]methyl]-4-pyridinyl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[[4-(2-morpholin-4-ylethoxy)phenyl]methyl]pyrimidin-4-yl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]methyl]pyrimidin-4-yl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[(3-morpholin-4-ylphenyl)methyl]pyrimidin-4-yl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[(4-morpholin-4-ylphenyl)methyl]pyrimidin-4-yl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[(6-morpholin-4-yl-3-pyridinyl)methyl]pyrimidin-4-yl]carbamate;[2-methyl-5-[2-oxo-2-[3-(trifluoromethyl)phenyl]ethyl]phenyl] N-(7H-cyclopenta[d]pyrimidin-4-yl)-N-methylcarbamate (CID 161234363) is (2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[(6-methyl-3-pyridinyl)methyl]pyrimidin-4-yl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[[3-(2-morpholin-4-ylethoxy)phenyl]methyl]-4-pyridinyl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[[4-(2-morpholin-4-ylethoxy)phenyl]methyl]pyrimidin-4-yl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]methyl]pyrimidin-4-yl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[(3-morpholin-4-ylphenyl)methyl]pyrimidin-4-yl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[(4-morpholin-4-ylphenyl)methyl]pyrimidin-4-yl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[(6-morpholin-4-yl-3-pyridinyl)methyl]pyrimidin-4-yl]carbamate;[2-methyl-5-[2-oxo-2-[3-(trifluoromethyl)phenyl]ethyl]phenyl] N-(7H-cyclopenta[d]pyrimidin-4-yl)-N-methylcarbamate.
What is the SMILES notation for (2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[(6-methyl-3-pyridinyl)methyl]pyrimidin-4-yl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[[3-(2-morpholin-4-ylethoxy)phenyl]methyl]-4-pyridinyl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[[4-(2-morpholin-4-ylethoxy)phenyl]methyl]pyrimidin-4-yl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]methyl]pyrimidin-4-yl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[(3-morpholin-4-ylphenyl)methyl]pyrimidin-4-yl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[(4-morpholin-4-ylphenyl)methyl]pyrimidin-4-yl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[(6-morpholin-4-yl-3-pyridinyl)methyl]pyrimidin-4-yl]carbamate;[2-methyl-5-[2-oxo-2-[3-(trifluoromethyl)phenyl]ethyl]phenyl] N-(7H-cyclopenta[d]pyrimidin-4-yl)-N-methylcarbamate?
The canonical SMILES for (2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[(6-methyl-3-pyridinyl)methyl]pyrimidin-4-yl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[[3-(2-morpholin-4-ylethoxy)phenyl]methyl]-4-pyridinyl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[[4-(2-morpholin-4-ylethoxy)phenyl]methyl]pyrimidin-4-yl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]methyl]pyrimidin-4-yl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[(3-morpholin-4-ylphenyl)methyl]pyrimidin-4-yl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[(4-morpholin-4-ylphenyl)methyl]pyrimidin-4-yl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[(6-morpholin-4-yl-3-pyridinyl)methyl]pyrimidin-4-yl]carbamate;[2-methyl-5-[2-oxo-2-[3-(trifluoromethyl)phenyl]ethyl]phenyl] N-(7H-cyclopenta[d]pyrimidin-4-yl)-N-methylcarbamate is COc1ccc(N(C(=O)Oc2c(C)cccc2C)c2ccnc(Cc3ccc(C)nc3)n2)c(OC)c1.COc1ccc(N(C(=O)Oc2c(C)cccc2C)c2ccnc(Cc3ccc(N4CCOCC4)cc3)n2)c(OC)c1.COc1ccc(N(C(=O)Oc2c(C)cccc2C)c2ccnc(Cc3ccc(N4CCOCC4)nc3)n2)c(OC)c1.COc1ccc(N(C(=O)Oc2c(C)cccc2C)c2ccnc(Cc3ccc(OCCN4CCOCC4)cc3)n2)c(OC)c1.COc1ccc(N(C(=O)Oc2c(C)cccc2C)c2ccnc(Cc3cccc(N4CCOCC4)c3)n2)c(OC)c1.COc1ccc(N(C(=O)Oc2c(C)cccc2C)c2ccnc(Cc3cccc(OCCN4CCOCC4)c3)c2)c(OC)c1.COc1ccc(N(C(=O)Oc2c(C)cccc2C)c2ccnc(Cc3cnn(CCN4CCOCC4)c3)n2)c(OC)c1.Cc1ccc(CC(=O)c2cccc(C(F)(F)F)c2)cc1OC(=O)N(C)c1ncnc2c1C=CC2.
What is the InChIKey of (2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[(6-methyl-3-pyridinyl)methyl]pyrimidin-4-yl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[[3-(2-morpholin-4-ylethoxy)phenyl]methyl]-4-pyridinyl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[[4-(2-morpholin-4-ylethoxy)phenyl]methyl]pyrimidin-4-yl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]methyl]pyrimidin-4-yl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[(3-morpholin-4-ylphenyl)methyl]pyrimidin-4-yl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[(4-morpholin-4-ylphenyl)methyl]pyrimidin-4-yl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[(6-morpholin-4-yl-3-pyridinyl)methyl]pyrimidin-4-yl]carbamate;[2-methyl-5-[2-oxo-2-[3-(trifluoromethyl)phenyl]ethyl]phenyl] N-(7H-cyclopenta[d]pyrimidin-4-yl)-N-methylcarbamate?
The InChIKey is UZEFAWAQLHHABQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C35H39N3O6.C34H38N4O6.2C32H34N4O5.C31H36N6O5.C31H33N5O5.C28H28N4O4.C25H20F3N3O3/c1-25-7-5-8-26(2)34(25)44-35(39)38(32-12-11-30(40-3)24-33(32)41-4)29-13-14-36-28(23-29)21-27-9-6-10-31(22-27)43-20-17-37-15-18-42-19-16-37;1-24-6-5-7-25(2)33(24)44-34(39)38(29-13-12-28(40-3)23-30(29)41-4)32-14-15-35-31(36-32)22-26-8-10-27(11-9-26)43-21-18-37-16-19-42-20-17-37;1-22-7-5-8-23(2)31(22)41-32(37)36(27-12-11-26(38-3)21-28(27)39-4)30-13-14-33-29(34-30)20-24-9-6-10-25(19-24)35-15-17-40-18-16-35;1-22-6-5-7-23(2)31(22)41-32(37)36(27-13-12-26(38-3)21-28(27)39-4)30-14-15-33-29(34-30)20-24-8-10-25(11-9-24)35-16-18-40-19-17-35;1-22-6-5-7-23(2)30(22)42-31(38)37(26-9-8-25(39-3)19-27(26)40-4)29-10-11-32-28(34-29)18-24-20-33-36(21-24)13-12-35-14-16-41-17-15-35;1-21-6-5-7-22(2)30(21)41-31(37)36(25-10-9-24(38-3)19-26(25)39-4)29-12-13-32-27(34-29)18-23-8-11-28(33-20-23)35-14-16-40-17-15-35;1-18-7-6-8-19(2)27(18)36-28(33)32(23-12-11-22(34-4)16-24(23)35-5)26-13-14-29-25(31-26)15-21-10-9-20(3)30-17-21;1-15-9-10-16(11-21(32)17-5-3-6-18(13-17)25(26,27)28)12-22(15)34-24(33)31(2)23-19-7-4-8-20(19)29-14-30-23/h5-14,22-24H,15-21H2,1-4H3;5-15,23H,16-22H2,1-4H3;5-14,19,21H,15-18,20H2,1-4H3;5-15,21H,16-20H2,1-4H3;5-11,19-21H,12-18H2,1-4H3;5-13,19-20H,14-18H2,1-4H3;6-14,16-17H,15H2,1-5H3;3-7,9-10,12-14H,8,11H2,1-2H3.
What are the key properties of (2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[(6-methyl-3-pyridinyl)methyl]pyrimidin-4-yl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[[3-(2-morpholin-4-ylethoxy)phenyl]methyl]-4-pyridinyl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[[4-(2-morpholin-4-ylethoxy)phenyl]methyl]pyrimidin-4-yl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]methyl]pyrimidin-4-yl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[(3-morpholin-4-ylphenyl)methyl]pyrimidin-4-yl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[(4-morpholin-4-ylphenyl)methyl]pyrimidin-4-yl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[(6-morpholin-4-yl-3-pyridinyl)methyl]pyrimidin-4-yl]carbamate;[2-methyl-5-[2-oxo-2-[3-(trifluoromethyl)phenyl]ethyl]phenyl] N-(7H-cyclopenta[d]pyrimidin-4-yl)-N-methylcarbamate?
(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[(6-methyl-3-pyridinyl)methyl]pyrimidin-4-yl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[[3-(2-morpholin-4-ylethoxy)phenyl]methyl]-4-pyridinyl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[[4-(2-morpholin-4-ylethoxy)phenyl]methyl]pyrimidin-4-yl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]methyl]pyrimidin-4-yl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[(3-morpholin-4-ylphenyl)methyl]pyrimidin-4-yl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[(4-morpholin-4-ylphenyl)methyl]pyrimidin-4-yl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[(6-morpholin-4-yl-3-pyridinyl)methyl]pyrimidin-4-yl]carbamate;[2-methyl-5-[2-oxo-2-[3-(trifluoromethyl)phenyl]ethyl]phenyl] N-(7H-cyclopenta[d]pyrimidin-4-yl)-N-methylcarbamate has a molecular weight of 4386.01 g/mol, XLogP of 44.87, 68 rotatable bonds, 0 hydrogen bond donors, and 64 hydrogen bond acceptors.
Where does this data come from?
All data for (2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[(6-methyl-3-pyridinyl)methyl]pyrimidin-4-yl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[[3-(2-morpholin-4-ylethoxy)phenyl]methyl]-4-pyridinyl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[[4-(2-morpholin-4-ylethoxy)phenyl]methyl]pyrimidin-4-yl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]methyl]pyrimidin-4-yl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[(3-morpholin-4-ylphenyl)methyl]pyrimidin-4-yl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[(4-morpholin-4-ylphenyl)methyl]pyrimidin-4-yl]carbamate;(2,6-dimethylphenyl) N-(2,4-dimethoxyphenyl)-N-[2-[(6-morpholin-4-yl-3-pyridinyl)methyl]pyrimidin-4-yl]carbamate;[2-methyl-5-[2-oxo-2-[3-(trifluoromethyl)phenyl]ethyl]phenyl] N-(7H-cyclopenta[d]pyrimidin-4-yl)-N-methylcarbamate is sourced from PubChem (CID 161234363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).