N-[4-(6-acetamido-1H-benzimidazol-2-yl)phenyl]-4-chlorobenzamide;N-[4-(6-benzamido-1H-benzimidazol-2-yl)phenyl]pyridine-3-carboxamide;4-chloro-N-[4-[6-(cyclopentanecarbonylamino)-1H-benzimidazol-2-yl]phenyl]benzamide;N-[2-[4-(cyclohexanecarbonylamino)phenyl]-3H-benzimidazol-5-yl]benzamide;2,4-dichloro-N-[2-[4-[(4-methoxybenzoyl)amino]phenyl]-3H-benzimidazol-5-yl]benzamide

C129H105Cl4N21O11 — CID 160911401

IUPACN-[4-(6-acetamido-1H-benzimidazol-2-yl)phenyl]-4-chlorobenzamide;N-[4-(6-benzamido-1H-benzimidazol-2-yl)phenyl]pyridine-3-carboxamide;4-chloro-N-[4-[6-(cyclopentanecarbonylamino)-1H-benzimidazol-2-yl]phenyl]benzamide;N-[2-[4-(cyclohexanecarbonylamino)phenyl]-3H-benzimidazol-5-yl]benzamide;2,4-dichloro-N-[2-[4-[(4-methoxybenzoyl)amino]phenyl]-3H-benzimidazol-5-yl]benzamide
SMILESCC(=O)Nc1ccc2nc(-c3ccc(NC(=O)c4ccc(Cl)cc4)cc3)[nH]c2c1.COc1ccc(C(=O)Nc2ccc(-c3nc4ccc(NC(=O)c5ccc(Cl)cc5Cl)cc4[nH]3)cc2)cc1.O=C(Nc1ccc(-c2nc3ccc(NC(=O)C4CCCC4)cc3[nH]2)cc1)c1ccc(Cl)cc1.O=C(Nc1ccc2nc(-c3ccc(NC(=O)C4CCCCC4)cc3)[nH]c2c1)c1ccccc1.O=C(Nc1ccc2nc(-c3ccc(NC(=O)c4cccnc4)cc3)[nH]c2c1)c1ccccc1
InChIInChI=1S/C28H20Cl2N4O3.C27H26N4O2.C26H23ClN4O2.C26H19N5O2.C22H17ClN4O2/c1-37-21-10-4-17(5-11-21)27(35)31-19-7-2-16(3-8-19)26-33-24-13-9-20(15-25(24)34-26)32-28(36)22-12-6-18(29)14-23(22)30;32-26(19-7-3-1-4-8-19)28-21-13-11-18(12-14-21)25-30-23-16-15-22(17-24(23)31-25)29-27(33)20-9-5-2-6-10-20;27-19-9-5-18(6-10-19)26(33)28-20-11-7-16(8-12-20)24-30-22-14-13-21(15-23(22)31-24)29-25(32)17-3-1-2-4-17;32-25(18-5-2-1-3-6-18)29-21-12-13-22-23(15-21)31-24(30-22)17-8-10-20(11-9-17)28-26(33)19-7-4-14-27-16-19;1-13(28)24-18-10-11-19-20(12-18)27-21(26-19)14-4-8-17(9-5-14)25-22(29)15-2-6-16(23)7-3-15/h2-15H,1H3,(H,31,35)(H,32,36)(H,33,34);2,5-6,9-17,19H,1,3-4,7-8H2,(H,28,32)(H,29,33)(H,30,31);5-15,17H,1-4H2,(H,28,33)(H,29,32)(H,30,31);1-16H,(H,28,33)(H,29,32)(H,30,31);2-12H,1H3,(H,24,28)(H,25,29)(H,26,27)
InChIKeySQVGWJJXJSFCSK-UHFFFAOYSA-N
MW2267.21 g/mol
LogP29.54
Rot. Bonds25

About N-[4-(6-acetamido-1H-benzimidazol-2-yl)phenyl]-4-chlorobenzamide;N-[4-(6-benzamido-1H-benzimidazol-2-yl)phenyl]pyridine-3-carboxamide;4-chloro-N-[4-[6-(cyclopentanecarbonylamino)-1H-benzimidazol-2-yl]phenyl]benzamide;N-[2-[4-(cyclohexanecarbonylamino)phenyl]-3H-benzimidazol-5-yl]benzamide;2,4-dichloro-N-[2-[4-[(4-methoxybenzoyl)amino]phenyl]-3H-benzimidazol-5-yl]benzamide

N-[4-(6-acetamido-1H-benzimidazol-2-yl)phenyl]-4-chlorobenzamide;N-[4-(6-benzamido-1H-benzimidazol-2-yl)phenyl]pyridine-3-carboxamide;4-chloro-N-[4-[6-(cyclopentanecarbonylamino)-1H-benzimidazol-2-yl]phenyl]benzamide;N-[2-[4-(cyclohexanecarbonylamino)phenyl]-3H-benzimidazol-5-yl]benzamide;2,4-dichloro-N-[2-[4-[(4-methoxybenzoyl)amino]phenyl]-3H-benzimidazol-5-yl]benzamide (PubChem CID 160911401) has the molecular formula C129H105Cl4N21O11 and a molecular weight of 2267.21 g/mol. Its IUPAC name is N-[4-(6-acetamido-1H-benzimidazol-2-yl)phenyl]-4-chlorobenzamide;N-[4-(6-benzamido-1H-benzimidazol-2-yl)phenyl]pyridine-3-carboxamide;4-chloro-N-[4-[6-(cyclopentanecarbonylamino)-1H-benzimidazol-2-yl]phenyl]benzamide;N-[2-[4-(cyclohexanecarbonylamino)phenyl]-3H-benzimidazol-5-yl]benzamide;2,4-dichloro-N-[2-[4-[(4-methoxybenzoyl)amino]phenyl]-3H-benzimidazol-5-yl]benzamide.

Molecular Properties

Compound NameN-[4-(6-acetamido-1H-benzimidazol-2-yl)phenyl]-4-chlorobenzamide;N-[4-(6-benzamido-1H-benzimidazol-2-yl)phenyl]pyridine-3-carboxamide;4-chloro-N-[4-[6-(cyclopentanecarbonylamino)-1H-benzimidazol-2-yl]phenyl]benzamide;N-[2-[4-(cyclohexanecarbonylamino)phenyl]-3H-benzimidazol-5-yl]benzamide;2,4-dichloro-N-[2-[4-[(4-methoxybenzoyl)amino]phenyl]-3H-benzimidazol-5-yl]benzamide
PubChem CID160911401
Molecular FormulaC129H105Cl4N21O11
Molecular Weight2267.21 g/mol
Exact Mass2263.71
IUPAC NameN-[4-(6-acetamido-1H-benzimidazol-2-yl)phenyl]-4-chlorobenzamide;N-[4-(6-benzamido-1H-benzimidazol-2-yl)phenyl]pyridine-3-carboxamide;4-chloro-N-[4-[6-(cyclopentanecarbonylamino)-1H-benzimidazol-2-yl]phenyl]benzamide;N-[2-[4-(cyclohexanecarbonylamino)phenyl]-3H-benzimidazol-5-yl]benzamide;2,4-dichloro-N-[2-[4-[(4-methoxybenzoyl)amino]phenyl]-3H-benzimidazol-5-yl]benzamide
SMILESCC(=O)Nc1ccc2nc(-c3ccc(NC(=O)c4ccc(Cl)cc4)cc3)[nH]c2c1.COc1ccc(C(=O)Nc2ccc(-c3nc4ccc(NC(=O)c5ccc(Cl)cc5Cl)cc4[nH]3)cc2)cc1.O=C(Nc1ccc(-c2nc3ccc(NC(=O)C4CCCC4)cc3[nH]2)cc1)c1ccc(Cl)cc1.O=C(Nc1ccc2nc(-c3ccc(NC(=O)C4CCCCC4)cc3)[nH]c2c1)c1ccccc1.O=C(Nc1ccc2nc(-c3ccc(NC(=O)c4cccnc4)cc3)[nH]c2c1)c1ccccc1
InChIInChI=1S/C28H20Cl2N4O3.C27H26N4O2.C26H23ClN4O2.C26H19N5O2.C22H17ClN4O2/c1-37-21-10-4-17(5-11-21)27(35)31-19-7-2-16(3-8-19)26-33-24-13-9-20(15-25(24)34-26)32-28(36)22-12-6-18(29)14-23(22)30;32-26(19-7-3-1-4-8-19)28-21-13-11-18(12-14-21)25-30-23-16-15-22(17-24(23)31-25)29-27(33)20-9-5-2-6-10-20;27-19-9-5-18(6-10-19)26(33)28-20-11-7-16(8-12-20)24-30-22-14-13-21(15-23(22)31-24)29-25(32)17-3-1-2-4-17;32-25(18-5-2-1-3-6-18)29-21-12-13-22-23(15-21)31-24(30-22)17-8-10-20(11-9-17)28-26(33)19-7-4-14-27-16-19;1-13(28)24-18-10-11-19-20(12-18)27-21(26-19)14-4-8-17(9-5-14)25-22(29)15-2-6-16(23)7-3-15/h2-15H,1H3,(H,31,35)(H,32,36)(H,33,34);2,5-6,9-17,19H,1,3-4,7-8H2,(H,28,32)(H,29,33)(H,30,31);5-15,17H,1-4H2,(H,28,33)(H,29,32)(H,30,31);1-16H,(H,28,33)(H,29,32)(H,30,31);2-12H,1H3,(H,24,28)(H,25,29)(H,26,27)
InChIKeySQVGWJJXJSFCSK-UHFFFAOYSA-N
XLogP29.54
TPSA456.52 Ų
H-Bond Donors15
H-Bond Acceptors17
Rotatable Bonds25
Heavy Atoms165
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002267.21
LogP ≤ 529.54
H-Bond Donors ≤ 515
H-Bond Acceptors ≤ 1017

Analyze N-[4-(6-acetamido-1H-benzimidazol-2-yl)phenyl]-4-chlorobenzamide;N-[4-(6-benzamido-1H-benzimidazol-2-yl)phenyl]pyridine-3-carboxamide;4-chloro-N-[4-[6-(cyclopentanecarbonylamino)-1H-benzimidazol-2-yl]phenyl]benzamide;N-[2-[4-(cyclohexanecarbonylamino)phenyl]-3H-benzimidazol-5-yl]benzamide;2,4-dichloro-N-[2-[4-[(4-methoxybenzoyl)amino]phenyl]-3H-benzimidazol-5-yl]benzamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-[4-(6-acetamido-1H-benzimidazol-2-yl)phenyl]-4-chlorobenzamide;N-[4-(6-benzamido-1H-benzimidazol-2-yl)phenyl]pyridine-3-carboxamide;4-chloro-N-[4-[6-(cyclopentanecarbonylamino)-1H-benzimidazol-2-yl]phenyl]benzamide;N-[2-[4-(cyclohexanecarbonylamino)phenyl]-3H-benzimidazol-5-yl]benzamide;2,4-dichloro-N-[2-[4-[(4-methoxybenzoyl)amino]phenyl]-3H-benzimidazol-5-yl]benzamide?
The IUPAC name of N-[4-(6-acetamido-1H-benzimidazol-2-yl)phenyl]-4-chlorobenzamide;N-[4-(6-benzamido-1H-benzimidazol-2-yl)phenyl]pyridine-3-carboxamide;4-chloro-N-[4-[6-(cyclopentanecarbonylamino)-1H-benzimidazol-2-yl]phenyl]benzamide;N-[2-[4-(cyclohexanecarbonylamino)phenyl]-3H-benzimidazol-5-yl]benzamide;2,4-dichloro-N-[2-[4-[(4-methoxybenzoyl)amino]phenyl]-3H-benzimidazol-5-yl]benzamide (CID 160911401) is N-[4-(6-acetamido-1H-benzimidazol-2-yl)phenyl]-4-chlorobenzamide;N-[4-(6-benzamido-1H-benzimidazol-2-yl)phenyl]pyridine-3-carboxamide;4-chloro-N-[4-[6-(cyclopentanecarbonylamino)-1H-benzimidazol-2-yl]phenyl]benzamide;N-[2-[4-(cyclohexanecarbonylamino)phenyl]-3H-benzimidazol-5-yl]benzamide;2,4-dichloro-N-[2-[4-[(4-methoxybenzoyl)amino]phenyl]-3H-benzimidazol-5-yl]benzamide.
What is the SMILES notation for N-[4-(6-acetamido-1H-benzimidazol-2-yl)phenyl]-4-chlorobenzamide;N-[4-(6-benzamido-1H-benzimidazol-2-yl)phenyl]pyridine-3-carboxamide;4-chloro-N-[4-[6-(cyclopentanecarbonylamino)-1H-benzimidazol-2-yl]phenyl]benzamide;N-[2-[4-(cyclohexanecarbonylamino)phenyl]-3H-benzimidazol-5-yl]benzamide;2,4-dichloro-N-[2-[4-[(4-methoxybenzoyl)amino]phenyl]-3H-benzimidazol-5-yl]benzamide?
The canonical SMILES for N-[4-(6-acetamido-1H-benzimidazol-2-yl)phenyl]-4-chlorobenzamide;N-[4-(6-benzamido-1H-benzimidazol-2-yl)phenyl]pyridine-3-carboxamide;4-chloro-N-[4-[6-(cyclopentanecarbonylamino)-1H-benzimidazol-2-yl]phenyl]benzamide;N-[2-[4-(cyclohexanecarbonylamino)phenyl]-3H-benzimidazol-5-yl]benzamide;2,4-dichloro-N-[2-[4-[(4-methoxybenzoyl)amino]phenyl]-3H-benzimidazol-5-yl]benzamide is CC(=O)Nc1ccc2nc(-c3ccc(NC(=O)c4ccc(Cl)cc4)cc3)[nH]c2c1.COc1ccc(C(=O)Nc2ccc(-c3nc4ccc(NC(=O)c5ccc(Cl)cc5Cl)cc4[nH]3)cc2)cc1.O=C(Nc1ccc(-c2nc3ccc(NC(=O)C4CCCC4)cc3[nH]2)cc1)c1ccc(Cl)cc1.O=C(Nc1ccc2nc(-c3ccc(NC(=O)C4CCCCC4)cc3)[nH]c2c1)c1ccccc1.O=C(Nc1ccc2nc(-c3ccc(NC(=O)c4cccnc4)cc3)[nH]c2c1)c1ccccc1.
What is the InChIKey of N-[4-(6-acetamido-1H-benzimidazol-2-yl)phenyl]-4-chlorobenzamide;N-[4-(6-benzamido-1H-benzimidazol-2-yl)phenyl]pyridine-3-carboxamide;4-chloro-N-[4-[6-(cyclopentanecarbonylamino)-1H-benzimidazol-2-yl]phenyl]benzamide;N-[2-[4-(cyclohexanecarbonylamino)phenyl]-3H-benzimidazol-5-yl]benzamide;2,4-dichloro-N-[2-[4-[(4-methoxybenzoyl)amino]phenyl]-3H-benzimidazol-5-yl]benzamide?
The InChIKey is SQVGWJJXJSFCSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H20Cl2N4O3.C27H26N4O2.C26H23ClN4O2.C26H19N5O2.C22H17ClN4O2/c1-37-21-10-4-17(5-11-21)27(35)31-19-7-2-16(3-8-19)26-33-24-13-9-20(15-25(24)34-26)32-28(36)22-12-6-18(29)14-23(22)30;32-26(19-7-3-1-4-8-19)28-21-13-11-18(12-14-21)25-30-23-16-15-22(17-24(23)31-25)29-27(33)20-9-5-2-6-10-20;27-19-9-5-18(6-10-19)26(33)28-20-11-7-16(8-12-20)24-30-22-14-13-21(15-23(22)31-24)29-25(32)17-3-1-2-4-17;32-25(18-5-2-1-3-6-18)29-21-12-13-22-23(15-21)31-24(30-22)17-8-10-20(11-9-17)28-26(33)19-7-4-14-27-16-19;1-13(28)24-18-10-11-19-20(12-18)27-21(26-19)14-4-8-17(9-5-14)25-22(29)15-2-6-16(23)7-3-15/h2-15H,1H3,(H,31,35)(H,32,36)(H,33,34);2,5-6,9-17,19H,1,3-4,7-8H2,(H,28,32)(H,29,33)(H,30,31);5-15,17H,1-4H2,(H,28,33)(H,29,32)(H,30,31);1-16H,(H,28,33)(H,29,32)(H,30,31);2-12H,1H3,(H,24,28)(H,25,29)(H,26,27).
What are the key properties of N-[4-(6-acetamido-1H-benzimidazol-2-yl)phenyl]-4-chlorobenzamide;N-[4-(6-benzamido-1H-benzimidazol-2-yl)phenyl]pyridine-3-carboxamide;4-chloro-N-[4-[6-(cyclopentanecarbonylamino)-1H-benzimidazol-2-yl]phenyl]benzamide;N-[2-[4-(cyclohexanecarbonylamino)phenyl]-3H-benzimidazol-5-yl]benzamide;2,4-dichloro-N-[2-[4-[(4-methoxybenzoyl)amino]phenyl]-3H-benzimidazol-5-yl]benzamide?
N-[4-(6-acetamido-1H-benzimidazol-2-yl)phenyl]-4-chlorobenzamide;N-[4-(6-benzamido-1H-benzimidazol-2-yl)phenyl]pyridine-3-carboxamide;4-chloro-N-[4-[6-(cyclopentanecarbonylamino)-1H-benzimidazol-2-yl]phenyl]benzamide;N-[2-[4-(cyclohexanecarbonylamino)phenyl]-3H-benzimidazol-5-yl]benzamide;2,4-dichloro-N-[2-[4-[(4-methoxybenzoyl)amino]phenyl]-3H-benzimidazol-5-yl]benzamide has a molecular weight of 2267.21 g/mol, XLogP of 29.54, 25 rotatable bonds, 15 hydrogen bond donors, and 17 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(6-acetamido-1H-benzimidazol-2-yl)phenyl]-4-chlorobenzamide;N-[4-(6-benzamido-1H-benzimidazol-2-yl)phenyl]pyridine-3-carboxamide;4-chloro-N-[4-[6-(cyclopentanecarbonylamino)-1H-benzimidazol-2-yl]phenyl]benzamide;N-[2-[4-(cyclohexanecarbonylamino)phenyl]-3H-benzimidazol-5-yl]benzamide;2,4-dichloro-N-[2-[4-[(4-methoxybenzoyl)amino]phenyl]-3H-benzimidazol-5-yl]benzamide is sourced from PubChem (CID 160911401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).