N-[3-[[3-[(E)-2-phenylethenyl]-1H-indazol-6-yl]oxy]phenyl]-1H-indole-4-carboxamide

C30H22N4O2 — CID 22978285

IUPACN-[3-[[3-[(E)-2-phenylethenyl]-1H-indazol-6-yl]oxy]phenyl]-1H-indole-4-carboxamide
SMILESO=C(Nc1cccc(Oc2ccc3c(/C=C/c4ccccc4)n[nH]c3c2)c1)c1cccc2[nH]ccc12
InChIInChI=1S/C30H22N4O2/c35-30(25-10-5-11-27-24(25)16-17-31-27)32-21-8-4-9-22(18-21)36-23-13-14-26-28(33-34-29(26)19-23)15-12-20-6-2-1-3-7-20/h1-19,31H,(H,32,35)(H,33,34)/b15-12+
InChIKeyRMRGQCNTCGUCGP-NTCAYCPXSA-N
MW470.53 g/mol
LogP7.26
Rot. Bonds6

About N-[3-[[3-[(E)-2-phenylethenyl]-1H-indazol-6-yl]oxy]phenyl]-1H-indole-4-carboxamide

N-[3-[[3-[(E)-2-phenylethenyl]-1H-indazol-6-yl]oxy]phenyl]-1H-indole-4-carboxamide (PubChem CID 22978285) has the molecular formula C30H22N4O2 and a molecular weight of 470.53 g/mol. Its IUPAC name is N-[3-[[3-[(E)-2-phenylethenyl]-1H-indazol-6-yl]oxy]phenyl]-1H-indole-4-carboxamide.

Molecular Properties

Compound NameN-[3-[[3-[(E)-2-phenylethenyl]-1H-indazol-6-yl]oxy]phenyl]-1H-indole-4-carboxamide
PubChem CID22978285
Molecular FormulaC30H22N4O2
Molecular Weight470.53 g/mol
Exact Mass470.17
IUPAC NameN-[3-[[3-[(E)-2-phenylethenyl]-1H-indazol-6-yl]oxy]phenyl]-1H-indole-4-carboxamide
SMILESO=C(Nc1cccc(Oc2ccc3c(/C=C/c4ccccc4)n[nH]c3c2)c1)c1cccc2[nH]ccc12
InChIInChI=1S/C30H22N4O2/c35-30(25-10-5-11-27-24(25)16-17-31-27)32-21-8-4-9-22(18-21)36-23-13-14-26-28(33-34-29(26)19-23)15-12-20-6-2-1-3-7-20/h1-19,31H,(H,32,35)(H,33,34)/b15-12+
InChIKeyRMRGQCNTCGUCGP-NTCAYCPXSA-N
XLogP7.26
TPSA82.80 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms36
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500470.53
LogP ≤ 57.26
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze N-[3-[[3-[(E)-2-phenylethenyl]-1H-indazol-6-yl]oxy]phenyl]-1H-indole-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[3-[[3-[(E)-2-phenylethenyl]-1H-indazol-6-yl]oxy]phenyl]-1H-indole-4-carboxamide?
The IUPAC name of N-[3-[[3-[(E)-2-phenylethenyl]-1H-indazol-6-yl]oxy]phenyl]-1H-indole-4-carboxamide (CID 22978285) is N-[3-[[3-[(E)-2-phenylethenyl]-1H-indazol-6-yl]oxy]phenyl]-1H-indole-4-carboxamide.
What is the SMILES notation for N-[3-[[3-[(E)-2-phenylethenyl]-1H-indazol-6-yl]oxy]phenyl]-1H-indole-4-carboxamide?
The canonical SMILES for N-[3-[[3-[(E)-2-phenylethenyl]-1H-indazol-6-yl]oxy]phenyl]-1H-indole-4-carboxamide is O=C(Nc1cccc(Oc2ccc3c(/C=C/c4ccccc4)n[nH]c3c2)c1)c1cccc2[nH]ccc12.
What is the InChIKey of N-[3-[[3-[(E)-2-phenylethenyl]-1H-indazol-6-yl]oxy]phenyl]-1H-indole-4-carboxamide?
The InChIKey is RMRGQCNTCGUCGP-NTCAYCPXSA-N. The full InChI is InChI=1S/C30H22N4O2/c35-30(25-10-5-11-27-24(25)16-17-31-27)32-21-8-4-9-22(18-21)36-23-13-14-26-28(33-34-29(26)19-23)15-12-20-6-2-1-3-7-20/h1-19,31H,(H,32,35)(H,33,34)/b15-12+.
What are the key properties of N-[3-[[3-[(E)-2-phenylethenyl]-1H-indazol-6-yl]oxy]phenyl]-1H-indole-4-carboxamide?
N-[3-[[3-[(E)-2-phenylethenyl]-1H-indazol-6-yl]oxy]phenyl]-1H-indole-4-carboxamide has a molecular weight of 470.53 g/mol, XLogP of 7.26, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[[3-[(E)-2-phenylethenyl]-1H-indazol-6-yl]oxy]phenyl]-1H-indole-4-carboxamide is sourced from PubChem (CID 22978285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).