N-[4-(5-benzamido-1-benzylbenzimidazol-2-yl)phenyl]benzamide;N-[4-[5-benzamido-1-[2-(dimethylamino)ethyl]benzimidazol-2-yl]phenyl]benzamide;N-[4-[5-benzamido-1-[3-(dimethylamino)propyl]benzimidazol-2-yl]phenyl]benzamide;N-[4-[5-benzamido-1-[(4-fluorophenyl)methyl]benzimidazol-2-yl]phenyl]benzamide;4-chloro-N-[4-[6-[(4-chlorobenzoyl)amino]-1H-benzimidazol-2-yl]phenyl]benzamide;4-fluoro-N-[4-[6-[(4-fluorobenzoyl)amino]-1H-benzimidazol-2-yl]phenyl]benzamide

C185H147Cl2F3N26O12 — CID 159139114

IUPACN-[4-(5-benzamido-1-benzylbenzimidazol-2-yl)phenyl]benzamide;N-[4-[5-benzamido-1-[2-(dimethylamino)ethyl]benzimidazol-2-yl]phenyl]benzamide;N-[4-[5-benzamido-1-[3-(dimethylamino)propyl]benzimidazol-2-yl]phenyl]benzamide;N-[4-[5-benzamido-1-[(4-fluorophenyl)methyl]benzimidazol-2-yl]phenyl]benzamide;4-chloro-N-[4-[6-[(4-chlorobenzoyl)amino]-1H-benzimidazol-2-yl]phenyl]benzamide;4-fluoro-N-[4-[6-[(4-fluorobenzoyl)amino]-1H-benzimidazol-2-yl]phenyl]benzamide
SMILESCN(C)CCCn1c(-c2ccc(NC(=O)c3ccccc3)cc2)nc2cc(NC(=O)c3ccccc3)ccc21.CN(C)CCn1c(-c2ccc(NC(=O)c3ccccc3)cc2)nc2cc(NC(=O)c3ccccc3)ccc21.O=C(Nc1ccc(-c2nc3cc(NC(=O)c4ccccc4)ccc3n2Cc2ccc(F)cc2)cc1)c1ccccc1.O=C(Nc1ccc(-c2nc3cc(NC(=O)c4ccccc4)ccc3n2Cc2ccccc2)cc1)c1ccccc1.O=C(Nc1ccc(-c2nc3ccc(NC(=O)c4ccc(Cl)cc4)cc3[nH]2)cc1)c1ccc(Cl)cc1.O=C(Nc1ccc(-c2nc3ccc(NC(=O)c4ccc(F)cc4)cc3[nH]2)cc1)c1ccc(F)cc1
InChIInChI=1S/C34H25FN4O2.C34H26N4O2.C32H31N5O2.C31H29N5O2.C27H18Cl2N4O2.C27H18F2N4O2/c35-27-15-11-23(12-16-27)22-39-31-20-19-29(37-34(41)26-9-5-2-6-10-26)21-30(31)38-32(39)24-13-17-28(18-14-24)36-33(40)25-7-3-1-4-8-25;39-33(26-12-6-2-7-13-26)35-28-18-16-25(17-19-28)32-37-30-22-29(36-34(40)27-14-8-3-9-15-27)20-21-31(30)38(32)23-24-10-4-1-5-11-24;1-36(2)20-9-21-37-29-19-18-27(34-32(39)25-12-7-4-8-13-25)22-28(29)35-30(37)23-14-16-26(17-15-23)33-31(38)24-10-5-3-6-11-24;1-35(2)19-20-36-28-18-17-26(33-31(38)24-11-7-4-8-12-24)21-27(28)34-29(36)22-13-15-25(16-14-22)32-30(37)23-9-5-3-6-10-23;2*28-19-7-1-17(2-8-19)26(34)30-21-11-5-16(6-12-21)25-32-23-14-13-22(15-24(23)33-25)31-27(35)18-3-9-20(29)10-4-18/h1-21H,22H2,(H,36,40)(H,37,41);1-22H,23H2,(H,35,39)(H,36,40);3-8,10-19,22H,9,20-21H2,1-2H3,(H,33,38)(H,34,39);3-18,21H,19-20H2,1-2H3,(H,32,37)(H,33,38);2*1-15H,(H,30,34)(H,31,35)(H,32,33)
InChIKeyKHWLMZXORJQINE-UHFFFAOYSA-N
MW3054.28 g/mol
LogP39.63
Rot. Bonds41

About N-[4-(5-benzamido-1-benzylbenzimidazol-2-yl)phenyl]benzamide;N-[4-[5-benzamido-1-[2-(dimethylamino)ethyl]benzimidazol-2-yl]phenyl]benzamide;N-[4-[5-benzamido-1-[3-(dimethylamino)propyl]benzimidazol-2-yl]phenyl]benzamide;N-[4-[5-benzamido-1-[(4-fluorophenyl)methyl]benzimidazol-2-yl]phenyl]benzamide;4-chloro-N-[4-[6-[(4-chlorobenzoyl)amino]-1H-benzimidazol-2-yl]phenyl]benzamide;4-fluoro-N-[4-[6-[(4-fluorobenzoyl)amino]-1H-benzimidazol-2-yl]phenyl]benzamide

N-[4-(5-benzamido-1-benzylbenzimidazol-2-yl)phenyl]benzamide;N-[4-[5-benzamido-1-[2-(dimethylamino)ethyl]benzimidazol-2-yl]phenyl]benzamide;N-[4-[5-benzamido-1-[3-(dimethylamino)propyl]benzimidazol-2-yl]phenyl]benzamide;N-[4-[5-benzamido-1-[(4-fluorophenyl)methyl]benzimidazol-2-yl]phenyl]benzamide;4-chloro-N-[4-[6-[(4-chlorobenzoyl)amino]-1H-benzimidazol-2-yl]phenyl]benzamide;4-fluoro-N-[4-[6-[(4-fluorobenzoyl)amino]-1H-benzimidazol-2-yl]phenyl]benzamide (PubChem CID 159139114) has the molecular formula C185H147Cl2F3N26O12 and a molecular weight of 3054.28 g/mol. Its IUPAC name is N-[4-(5-benzamido-1-benzylbenzimidazol-2-yl)phenyl]benzamide;N-[4-[5-benzamido-1-[2-(dimethylamino)ethyl]benzimidazol-2-yl]phenyl]benzamide;N-[4-[5-benzamido-1-[3-(dimethylamino)propyl]benzimidazol-2-yl]phenyl]benzamide;N-[4-[5-benzamido-1-[(4-fluorophenyl)methyl]benzimidazol-2-yl]phenyl]benzamide;4-chloro-N-[4-[6-[(4-chlorobenzoyl)amino]-1H-benzimidazol-2-yl]phenyl]benzamide;4-fluoro-N-[4-[6-[(4-fluorobenzoyl)amino]-1H-benzimidazol-2-yl]phenyl]benzamide.

Molecular Properties

Compound NameN-[4-(5-benzamido-1-benzylbenzimidazol-2-yl)phenyl]benzamide;N-[4-[5-benzamido-1-[2-(dimethylamino)ethyl]benzimidazol-2-yl]phenyl]benzamide;N-[4-[5-benzamido-1-[3-(dimethylamino)propyl]benzimidazol-2-yl]phenyl]benzamide;N-[4-[5-benzamido-1-[(4-fluorophenyl)methyl]benzimidazol-2-yl]phenyl]benzamide;4-chloro-N-[4-[6-[(4-chlorobenzoyl)amino]-1H-benzimidazol-2-yl]phenyl]benzamide;4-fluoro-N-[4-[6-[(4-fluorobenzoyl)amino]-1H-benzimidazol-2-yl]phenyl]benzamide
PubChem CID159139114
Molecular FormulaC185H147Cl2F3N26O12
Molecular Weight3054.28 g/mol
Exact Mass3051.10
IUPAC NameN-[4-(5-benzamido-1-benzylbenzimidazol-2-yl)phenyl]benzamide;N-[4-[5-benzamido-1-[2-(dimethylamino)ethyl]benzimidazol-2-yl]phenyl]benzamide;N-[4-[5-benzamido-1-[3-(dimethylamino)propyl]benzimidazol-2-yl]phenyl]benzamide;N-[4-[5-benzamido-1-[(4-fluorophenyl)methyl]benzimidazol-2-yl]phenyl]benzamide;4-chloro-N-[4-[6-[(4-chlorobenzoyl)amino]-1H-benzimidazol-2-yl]phenyl]benzamide;4-fluoro-N-[4-[6-[(4-fluorobenzoyl)amino]-1H-benzimidazol-2-yl]phenyl]benzamide
SMILESCN(C)CCCn1c(-c2ccc(NC(=O)c3ccccc3)cc2)nc2cc(NC(=O)c3ccccc3)ccc21.CN(C)CCn1c(-c2ccc(NC(=O)c3ccccc3)cc2)nc2cc(NC(=O)c3ccccc3)ccc21.O=C(Nc1ccc(-c2nc3cc(NC(=O)c4ccccc4)ccc3n2Cc2ccc(F)cc2)cc1)c1ccccc1.O=C(Nc1ccc(-c2nc3cc(NC(=O)c4ccccc4)ccc3n2Cc2ccccc2)cc1)c1ccccc1.O=C(Nc1ccc(-c2nc3ccc(NC(=O)c4ccc(Cl)cc4)cc3[nH]2)cc1)c1ccc(Cl)cc1.O=C(Nc1ccc(-c2nc3ccc(NC(=O)c4ccc(F)cc4)cc3[nH]2)cc1)c1ccc(F)cc1
InChIInChI=1S/C34H25FN4O2.C34H26N4O2.C32H31N5O2.C31H29N5O2.C27H18Cl2N4O2.C27H18F2N4O2/c35-27-15-11-23(12-16-27)22-39-31-20-19-29(37-34(41)26-9-5-2-6-10-26)21-30(31)38-32(39)24-13-17-28(18-14-24)36-33(40)25-7-3-1-4-8-25;39-33(26-12-6-2-7-13-26)35-28-18-16-25(17-19-28)32-37-30-22-29(36-34(40)27-14-8-3-9-15-27)20-21-31(30)38(32)23-24-10-4-1-5-11-24;1-36(2)20-9-21-37-29-19-18-27(34-32(39)25-12-7-4-8-13-25)22-28(29)35-30(37)23-14-16-26(17-15-23)33-31(38)24-10-5-3-6-11-24;1-35(2)19-20-36-28-18-17-26(33-31(38)24-11-7-4-8-12-24)21-27(28)34-29(36)22-13-15-25(16-14-22)32-30(37)23-9-5-3-6-10-23;2*28-19-7-1-17(2-8-19)26(34)30-21-11-5-16(6-12-21)25-32-23-14-13-22(15-24(23)33-25)31-27(35)18-3-9-20(29)10-4-18/h1-21H,22H2,(H,36,40)(H,37,41);1-22H,23H2,(H,35,39)(H,36,40);3-8,10-19,22H,9,20-21H2,1-2H3,(H,33,38)(H,34,39);3-18,21H,19-20H2,1-2H3,(H,32,37)(H,33,38);2*1-15H,(H,30,34)(H,31,35)(H,32,33)
InChIKeyKHWLMZXORJQINE-UHFFFAOYSA-N
XLogP39.63
TPSA484.32 Ų
H-Bond Donors14
H-Bond Acceptors24
Rotatable Bonds41
Heavy Atoms228
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003054.28
LogP ≤ 539.63
H-Bond Donors ≤ 514
H-Bond Acceptors ≤ 1024

Analyze N-[4-(5-benzamido-1-benzylbenzimidazol-2-yl)phenyl]benzamide;N-[4-[5-benzamido-1-[2-(dimethylamino)ethyl]benzimidazol-2-yl]phenyl]benzamide;N-[4-[5-benzamido-1-[3-(dimethylamino)propyl]benzimidazol-2-yl]phenyl]benzamide;N-[4-[5-benzamido-1-[(4-fluorophenyl)methyl]benzimidazol-2-yl]phenyl]benzamide;4-chloro-N-[4-[6-[(4-chlorobenzoyl)amino]-1H-benzimidazol-2-yl]phenyl]benzamide;4-fluoro-N-[4-[6-[(4-fluorobenzoyl)amino]-1H-benzimidazol-2-yl]phenyl]benzamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-[4-(5-benzamido-1-benzylbenzimidazol-2-yl)phenyl]benzamide;N-[4-[5-benzamido-1-[2-(dimethylamino)ethyl]benzimidazol-2-yl]phenyl]benzamide;N-[4-[5-benzamido-1-[3-(dimethylamino)propyl]benzimidazol-2-yl]phenyl]benzamide;N-[4-[5-benzamido-1-[(4-fluorophenyl)methyl]benzimidazol-2-yl]phenyl]benzamide;4-chloro-N-[4-[6-[(4-chlorobenzoyl)amino]-1H-benzimidazol-2-yl]phenyl]benzamide;4-fluoro-N-[4-[6-[(4-fluorobenzoyl)amino]-1H-benzimidazol-2-yl]phenyl]benzamide?
The IUPAC name of N-[4-(5-benzamido-1-benzylbenzimidazol-2-yl)phenyl]benzamide;N-[4-[5-benzamido-1-[2-(dimethylamino)ethyl]benzimidazol-2-yl]phenyl]benzamide;N-[4-[5-benzamido-1-[3-(dimethylamino)propyl]benzimidazol-2-yl]phenyl]benzamide;N-[4-[5-benzamido-1-[(4-fluorophenyl)methyl]benzimidazol-2-yl]phenyl]benzamide;4-chloro-N-[4-[6-[(4-chlorobenzoyl)amino]-1H-benzimidazol-2-yl]phenyl]benzamide;4-fluoro-N-[4-[6-[(4-fluorobenzoyl)amino]-1H-benzimidazol-2-yl]phenyl]benzamide (CID 159139114) is N-[4-(5-benzamido-1-benzylbenzimidazol-2-yl)phenyl]benzamide;N-[4-[5-benzamido-1-[2-(dimethylamino)ethyl]benzimidazol-2-yl]phenyl]benzamide;N-[4-[5-benzamido-1-[3-(dimethylamino)propyl]benzimidazol-2-yl]phenyl]benzamide;N-[4-[5-benzamido-1-[(4-fluorophenyl)methyl]benzimidazol-2-yl]phenyl]benzamide;4-chloro-N-[4-[6-[(4-chlorobenzoyl)amino]-1H-benzimidazol-2-yl]phenyl]benzamide;4-fluoro-N-[4-[6-[(4-fluorobenzoyl)amino]-1H-benzimidazol-2-yl]phenyl]benzamide.
What is the SMILES notation for N-[4-(5-benzamido-1-benzylbenzimidazol-2-yl)phenyl]benzamide;N-[4-[5-benzamido-1-[2-(dimethylamino)ethyl]benzimidazol-2-yl]phenyl]benzamide;N-[4-[5-benzamido-1-[3-(dimethylamino)propyl]benzimidazol-2-yl]phenyl]benzamide;N-[4-[5-benzamido-1-[(4-fluorophenyl)methyl]benzimidazol-2-yl]phenyl]benzamide;4-chloro-N-[4-[6-[(4-chlorobenzoyl)amino]-1H-benzimidazol-2-yl]phenyl]benzamide;4-fluoro-N-[4-[6-[(4-fluorobenzoyl)amino]-1H-benzimidazol-2-yl]phenyl]benzamide?
The canonical SMILES for N-[4-(5-benzamido-1-benzylbenzimidazol-2-yl)phenyl]benzamide;N-[4-[5-benzamido-1-[2-(dimethylamino)ethyl]benzimidazol-2-yl]phenyl]benzamide;N-[4-[5-benzamido-1-[3-(dimethylamino)propyl]benzimidazol-2-yl]phenyl]benzamide;N-[4-[5-benzamido-1-[(4-fluorophenyl)methyl]benzimidazol-2-yl]phenyl]benzamide;4-chloro-N-[4-[6-[(4-chlorobenzoyl)amino]-1H-benzimidazol-2-yl]phenyl]benzamide;4-fluoro-N-[4-[6-[(4-fluorobenzoyl)amino]-1H-benzimidazol-2-yl]phenyl]benzamide is CN(C)CCCn1c(-c2ccc(NC(=O)c3ccccc3)cc2)nc2cc(NC(=O)c3ccccc3)ccc21.CN(C)CCn1c(-c2ccc(NC(=O)c3ccccc3)cc2)nc2cc(NC(=O)c3ccccc3)ccc21.O=C(Nc1ccc(-c2nc3cc(NC(=O)c4ccccc4)ccc3n2Cc2ccc(F)cc2)cc1)c1ccccc1.O=C(Nc1ccc(-c2nc3cc(NC(=O)c4ccccc4)ccc3n2Cc2ccccc2)cc1)c1ccccc1.O=C(Nc1ccc(-c2nc3ccc(NC(=O)c4ccc(Cl)cc4)cc3[nH]2)cc1)c1ccc(Cl)cc1.O=C(Nc1ccc(-c2nc3ccc(NC(=O)c4ccc(F)cc4)cc3[nH]2)cc1)c1ccc(F)cc1.
What is the InChIKey of N-[4-(5-benzamido-1-benzylbenzimidazol-2-yl)phenyl]benzamide;N-[4-[5-benzamido-1-[2-(dimethylamino)ethyl]benzimidazol-2-yl]phenyl]benzamide;N-[4-[5-benzamido-1-[3-(dimethylamino)propyl]benzimidazol-2-yl]phenyl]benzamide;N-[4-[5-benzamido-1-[(4-fluorophenyl)methyl]benzimidazol-2-yl]phenyl]benzamide;4-chloro-N-[4-[6-[(4-chlorobenzoyl)amino]-1H-benzimidazol-2-yl]phenyl]benzamide;4-fluoro-N-[4-[6-[(4-fluorobenzoyl)amino]-1H-benzimidazol-2-yl]phenyl]benzamide?
The InChIKey is KHWLMZXORJQINE-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H25FN4O2.C34H26N4O2.C32H31N5O2.C31H29N5O2.C27H18Cl2N4O2.C27H18F2N4O2/c35-27-15-11-23(12-16-27)22-39-31-20-19-29(37-34(41)26-9-5-2-6-10-26)21-30(31)38-32(39)24-13-17-28(18-14-24)36-33(40)25-7-3-1-4-8-25;39-33(26-12-6-2-7-13-26)35-28-18-16-25(17-19-28)32-37-30-22-29(36-34(40)27-14-8-3-9-15-27)20-21-31(30)38(32)23-24-10-4-1-5-11-24;1-36(2)20-9-21-37-29-19-18-27(34-32(39)25-12-7-4-8-13-25)22-28(29)35-30(37)23-14-16-26(17-15-23)33-31(38)24-10-5-3-6-11-24;1-35(2)19-20-36-28-18-17-26(33-31(38)24-11-7-4-8-12-24)21-27(28)34-29(36)22-13-15-25(16-14-22)32-30(37)23-9-5-3-6-10-23;2*28-19-7-1-17(2-8-19)26(34)30-21-11-5-16(6-12-21)25-32-23-14-13-22(15-24(23)33-25)31-27(35)18-3-9-20(29)10-4-18/h1-21H,22H2,(H,36,40)(H,37,41);1-22H,23H2,(H,35,39)(H,36,40);3-8,10-19,22H,9,20-21H2,1-2H3,(H,33,38)(H,34,39);3-18,21H,19-20H2,1-2H3,(H,32,37)(H,33,38);2*1-15H,(H,30,34)(H,31,35)(H,32,33).
What are the key properties of N-[4-(5-benzamido-1-benzylbenzimidazol-2-yl)phenyl]benzamide;N-[4-[5-benzamido-1-[2-(dimethylamino)ethyl]benzimidazol-2-yl]phenyl]benzamide;N-[4-[5-benzamido-1-[3-(dimethylamino)propyl]benzimidazol-2-yl]phenyl]benzamide;N-[4-[5-benzamido-1-[(4-fluorophenyl)methyl]benzimidazol-2-yl]phenyl]benzamide;4-chloro-N-[4-[6-[(4-chlorobenzoyl)amino]-1H-benzimidazol-2-yl]phenyl]benzamide;4-fluoro-N-[4-[6-[(4-fluorobenzoyl)amino]-1H-benzimidazol-2-yl]phenyl]benzamide?
N-[4-(5-benzamido-1-benzylbenzimidazol-2-yl)phenyl]benzamide;N-[4-[5-benzamido-1-[2-(dimethylamino)ethyl]benzimidazol-2-yl]phenyl]benzamide;N-[4-[5-benzamido-1-[3-(dimethylamino)propyl]benzimidazol-2-yl]phenyl]benzamide;N-[4-[5-benzamido-1-[(4-fluorophenyl)methyl]benzimidazol-2-yl]phenyl]benzamide;4-chloro-N-[4-[6-[(4-chlorobenzoyl)amino]-1H-benzimidazol-2-yl]phenyl]benzamide;4-fluoro-N-[4-[6-[(4-fluorobenzoyl)amino]-1H-benzimidazol-2-yl]phenyl]benzamide has a molecular weight of 3054.28 g/mol, XLogP of 39.63, 41 rotatable bonds, 14 hydrogen bond donors, and 24 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(5-benzamido-1-benzylbenzimidazol-2-yl)phenyl]benzamide;N-[4-[5-benzamido-1-[2-(dimethylamino)ethyl]benzimidazol-2-yl]phenyl]benzamide;N-[4-[5-benzamido-1-[3-(dimethylamino)propyl]benzimidazol-2-yl]phenyl]benzamide;N-[4-[5-benzamido-1-[(4-fluorophenyl)methyl]benzimidazol-2-yl]phenyl]benzamide;4-chloro-N-[4-[6-[(4-chlorobenzoyl)amino]-1H-benzimidazol-2-yl]phenyl]benzamide;4-fluoro-N-[4-[6-[(4-fluorobenzoyl)amino]-1H-benzimidazol-2-yl]phenyl]benzamide is sourced from PubChem (CID 159139114), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).