N-(5-bromo-2-pyridinyl)-5-methyl-2-[[4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]benzamide;N-(5-chloro-2-pyridinyl)-2-[[2-fluoro-4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]-3-methoxy-5-methylbenzamide;N-(5-chloro-2-pyridinyl)-2-[[2-fluoro-4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]-5-methylbenzamide;N-(5-chloro-2-pyridinyl)-3-methoxy-5-methyl-2-[[4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]benzamide

C98H90BrCl3F2N20O10 — CID 91118616

IUPACN-(5-bromo-2-pyridinyl)-5-methyl-2-[[4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]benzamide;N-(5-chloro-2-pyridinyl)-2-[[2-fluoro-4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]-3-methoxy-5-methylbenzamide;N-(5-chloro-2-pyridinyl)-2-[[2-fluoro-4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]-5-methylbenzamide;N-(5-chloro-2-pyridinyl)-3-methoxy-5-methyl-2-[[4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]benzamide
SMILESCOc1cc(C)cc(C(=O)Nc2ccc(Cl)cn2)c1NC(=O)c1ccc(C2=NCCN2C)cc1.COc1cc(C)cc(C(=O)Nc2ccc(Cl)cn2)c1NC(=O)c1ccc(C2=NCCN2C)cc1F.Cc1ccc(NC(=O)c2ccc(C3=NCCN3C)cc2)c(C(=O)Nc2ccc(Br)cn2)c1.Cc1ccc(NC(=O)c2ccc(C3=NCCN3C)cc2F)c(C(=O)Nc2ccc(Cl)cn2)c1
InChIInChI=1S/C25H23ClFN5O3.C25H24ClN5O3.C24H22BrN5O2.C24H21ClFN5O2/c1-14-10-18(25(34)30-21-7-5-16(26)13-29-21)22(20(11-14)35-3)31-24(33)17-6-4-15(12-19(17)27)23-28-8-9-32(23)2;1-15-12-19(25(33)29-21-9-8-18(26)14-28-21)22(20(13-15)34-3)30-24(32)17-6-4-16(5-7-17)23-27-10-11-31(23)2;1-15-3-9-20(19(13-15)24(32)29-21-10-8-18(25)14-27-21)28-23(31)17-6-4-16(5-7-17)22-26-11-12-30(22)2;1-14-3-7-20(18(11-14)24(33)30-21-8-5-16(25)13-28-21)29-23(32)17-6-4-15(12-19(17)26)22-27-9-10-31(22)2/h4-7,10-13H,8-9H2,1-3H3,(H,31,33)(H,29,30,34);4-9,12-14H,10-11H2,1-3H3,(H,30,32)(H,28,29,33);3-10,13-14H,11-12H2,1-2H3,(H,28,31)(H,27,29,32);3-8,11-13H,9-10H2,1-2H3,(H,29,32)(H,28,30,33)
InChIKeyMGOJUEQEHNMXRR-UHFFFAOYSA-N
MW1932.19 g/mol
LogP17.36
Rot. Bonds22

About N-(5-bromo-2-pyridinyl)-5-methyl-2-[[4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]benzamide;N-(5-chloro-2-pyridinyl)-2-[[2-fluoro-4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]-3-methoxy-5-methylbenzamide;N-(5-chloro-2-pyridinyl)-2-[[2-fluoro-4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]-5-methylbenzamide;N-(5-chloro-2-pyridinyl)-3-methoxy-5-methyl-2-[[4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]benzamide

N-(5-bromo-2-pyridinyl)-5-methyl-2-[[4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]benzamide;N-(5-chloro-2-pyridinyl)-2-[[2-fluoro-4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]-3-methoxy-5-methylbenzamide;N-(5-chloro-2-pyridinyl)-2-[[2-fluoro-4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]-5-methylbenzamide;N-(5-chloro-2-pyridinyl)-3-methoxy-5-methyl-2-[[4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]benzamide (PubChem CID 91118616) has the molecular formula C98H90BrCl3F2N20O10 and a molecular weight of 1932.19 g/mol. Its IUPAC name is N-(5-bromo-2-pyridinyl)-5-methyl-2-[[4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]benzamide;N-(5-chloro-2-pyridinyl)-2-[[2-fluoro-4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]-3-methoxy-5-methylbenzamide;N-(5-chloro-2-pyridinyl)-2-[[2-fluoro-4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]-5-methylbenzamide;N-(5-chloro-2-pyridinyl)-3-methoxy-5-methyl-2-[[4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]benzamide.

Molecular Properties

Compound NameN-(5-bromo-2-pyridinyl)-5-methyl-2-[[4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]benzamide;N-(5-chloro-2-pyridinyl)-2-[[2-fluoro-4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]-3-methoxy-5-methylbenzamide;N-(5-chloro-2-pyridinyl)-2-[[2-fluoro-4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]-5-methylbenzamide;N-(5-chloro-2-pyridinyl)-3-methoxy-5-methyl-2-[[4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]benzamide
PubChem CID91118616
Molecular FormulaC98H90BrCl3F2N20O10
Molecular Weight1932.19 g/mol
Exact Mass1928.54
IUPAC NameN-(5-bromo-2-pyridinyl)-5-methyl-2-[[4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]benzamide;N-(5-chloro-2-pyridinyl)-2-[[2-fluoro-4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]-3-methoxy-5-methylbenzamide;N-(5-chloro-2-pyridinyl)-2-[[2-fluoro-4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]-5-methylbenzamide;N-(5-chloro-2-pyridinyl)-3-methoxy-5-methyl-2-[[4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]benzamide
SMILESCOc1cc(C)cc(C(=O)Nc2ccc(Cl)cn2)c1NC(=O)c1ccc(C2=NCCN2C)cc1.COc1cc(C)cc(C(=O)Nc2ccc(Cl)cn2)c1NC(=O)c1ccc(C2=NCCN2C)cc1F.Cc1ccc(NC(=O)c2ccc(C3=NCCN3C)cc2)c(C(=O)Nc2ccc(Br)cn2)c1.Cc1ccc(NC(=O)c2ccc(C3=NCCN3C)cc2F)c(C(=O)Nc2ccc(Cl)cn2)c1
InChIInChI=1S/C25H23ClFN5O3.C25H24ClN5O3.C24H22BrN5O2.C24H21ClFN5O2/c1-14-10-18(25(34)30-21-7-5-16(26)13-29-21)22(20(11-14)35-3)31-24(33)17-6-4-15(12-19(17)27)23-28-8-9-32(23)2;1-15-12-19(25(33)29-21-9-8-18(26)14-28-21)22(20(13-15)34-3)30-24(32)17-6-4-16(5-7-17)23-27-10-11-31(23)2;1-15-3-9-20(19(13-15)24(32)29-21-10-8-18(25)14-27-21)28-23(31)17-6-4-16(5-7-17)22-26-11-12-30(22)2;1-14-3-7-20(18(11-14)24(33)30-21-8-5-16(25)13-28-21)29-23(32)17-6-4-15(12-19(17)26)22-27-9-10-31(22)2/h4-7,10-13H,8-9H2,1-3H3,(H,31,33)(H,29,30,34);4-9,12-14H,10-11H2,1-3H3,(H,30,32)(H,28,29,33);3-10,13-14H,11-12H2,1-2H3,(H,28,31)(H,27,29,32);3-8,11-13H,9-10H2,1-2H3,(H,29,32)(H,28,30,33)
InChIKeyMGOJUEQEHNMXRR-UHFFFAOYSA-N
XLogP17.36
TPSA365.22 Ų
H-Bond Donors8
H-Bond Acceptors22
Rotatable Bonds22
Heavy Atoms134
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001932.19
LogP ≤ 517.36
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1022

Analyze N-(5-bromo-2-pyridinyl)-5-methyl-2-[[4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]benzamide;N-(5-chloro-2-pyridinyl)-2-[[2-fluoro-4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]-3-methoxy-5-methylbenzamide;N-(5-chloro-2-pyridinyl)-2-[[2-fluoro-4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]-5-methylbenzamide;N-(5-chloro-2-pyridinyl)-3-methoxy-5-methyl-2-[[4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]benzamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-(5-bromo-2-pyridinyl)-5-methyl-2-[[4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]benzamide;N-(5-chloro-2-pyridinyl)-2-[[2-fluoro-4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]-3-methoxy-5-methylbenzamide;N-(5-chloro-2-pyridinyl)-2-[[2-fluoro-4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]-5-methylbenzamide;N-(5-chloro-2-pyridinyl)-3-methoxy-5-methyl-2-[[4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]benzamide?
The IUPAC name of N-(5-bromo-2-pyridinyl)-5-methyl-2-[[4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]benzamide;N-(5-chloro-2-pyridinyl)-2-[[2-fluoro-4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]-3-methoxy-5-methylbenzamide;N-(5-chloro-2-pyridinyl)-2-[[2-fluoro-4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]-5-methylbenzamide;N-(5-chloro-2-pyridinyl)-3-methoxy-5-methyl-2-[[4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]benzamide (CID 91118616) is N-(5-bromo-2-pyridinyl)-5-methyl-2-[[4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]benzamide;N-(5-chloro-2-pyridinyl)-2-[[2-fluoro-4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]-3-methoxy-5-methylbenzamide;N-(5-chloro-2-pyridinyl)-2-[[2-fluoro-4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]-5-methylbenzamide;N-(5-chloro-2-pyridinyl)-3-methoxy-5-methyl-2-[[4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]benzamide.
What is the SMILES notation for N-(5-bromo-2-pyridinyl)-5-methyl-2-[[4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]benzamide;N-(5-chloro-2-pyridinyl)-2-[[2-fluoro-4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]-3-methoxy-5-methylbenzamide;N-(5-chloro-2-pyridinyl)-2-[[2-fluoro-4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]-5-methylbenzamide;N-(5-chloro-2-pyridinyl)-3-methoxy-5-methyl-2-[[4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]benzamide?
The canonical SMILES for N-(5-bromo-2-pyridinyl)-5-methyl-2-[[4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]benzamide;N-(5-chloro-2-pyridinyl)-2-[[2-fluoro-4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]-3-methoxy-5-methylbenzamide;N-(5-chloro-2-pyridinyl)-2-[[2-fluoro-4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]-5-methylbenzamide;N-(5-chloro-2-pyridinyl)-3-methoxy-5-methyl-2-[[4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]benzamide is COc1cc(C)cc(C(=O)Nc2ccc(Cl)cn2)c1NC(=O)c1ccc(C2=NCCN2C)cc1.COc1cc(C)cc(C(=O)Nc2ccc(Cl)cn2)c1NC(=O)c1ccc(C2=NCCN2C)cc1F.Cc1ccc(NC(=O)c2ccc(C3=NCCN3C)cc2)c(C(=O)Nc2ccc(Br)cn2)c1.Cc1ccc(NC(=O)c2ccc(C3=NCCN3C)cc2F)c(C(=O)Nc2ccc(Cl)cn2)c1.
What is the InChIKey of N-(5-bromo-2-pyridinyl)-5-methyl-2-[[4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]benzamide;N-(5-chloro-2-pyridinyl)-2-[[2-fluoro-4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]-3-methoxy-5-methylbenzamide;N-(5-chloro-2-pyridinyl)-2-[[2-fluoro-4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]-5-methylbenzamide;N-(5-chloro-2-pyridinyl)-3-methoxy-5-methyl-2-[[4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]benzamide?
The InChIKey is MGOJUEQEHNMXRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H23ClFN5O3.C25H24ClN5O3.C24H22BrN5O2.C24H21ClFN5O2/c1-14-10-18(25(34)30-21-7-5-16(26)13-29-21)22(20(11-14)35-3)31-24(33)17-6-4-15(12-19(17)27)23-28-8-9-32(23)2;1-15-12-19(25(33)29-21-9-8-18(26)14-28-21)22(20(13-15)34-3)30-24(32)17-6-4-16(5-7-17)23-27-10-11-31(23)2;1-15-3-9-20(19(13-15)24(32)29-21-10-8-18(25)14-27-21)28-23(31)17-6-4-16(5-7-17)22-26-11-12-30(22)2;1-14-3-7-20(18(11-14)24(33)30-21-8-5-16(25)13-28-21)29-23(32)17-6-4-15(12-19(17)26)22-27-9-10-31(22)2/h4-7,10-13H,8-9H2,1-3H3,(H,31,33)(H,29,30,34);4-9,12-14H,10-11H2,1-3H3,(H,30,32)(H,28,29,33);3-10,13-14H,11-12H2,1-2H3,(H,28,31)(H,27,29,32);3-8,11-13H,9-10H2,1-2H3,(H,29,32)(H,28,30,33).
What are the key properties of N-(5-bromo-2-pyridinyl)-5-methyl-2-[[4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]benzamide;N-(5-chloro-2-pyridinyl)-2-[[2-fluoro-4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]-3-methoxy-5-methylbenzamide;N-(5-chloro-2-pyridinyl)-2-[[2-fluoro-4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]-5-methylbenzamide;N-(5-chloro-2-pyridinyl)-3-methoxy-5-methyl-2-[[4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]benzamide?
N-(5-bromo-2-pyridinyl)-5-methyl-2-[[4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]benzamide;N-(5-chloro-2-pyridinyl)-2-[[2-fluoro-4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]-3-methoxy-5-methylbenzamide;N-(5-chloro-2-pyridinyl)-2-[[2-fluoro-4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]-5-methylbenzamide;N-(5-chloro-2-pyridinyl)-3-methoxy-5-methyl-2-[[4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]benzamide has a molecular weight of 1932.19 g/mol, XLogP of 17.36, 22 rotatable bonds, 8 hydrogen bond donors, and 22 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-bromo-2-pyridinyl)-5-methyl-2-[[4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]benzamide;N-(5-chloro-2-pyridinyl)-2-[[2-fluoro-4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]-3-methoxy-5-methylbenzamide;N-(5-chloro-2-pyridinyl)-2-[[2-fluoro-4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]-5-methylbenzamide;N-(5-chloro-2-pyridinyl)-3-methoxy-5-methyl-2-[[4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]benzamide is sourced from PubChem (CID 91118616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).