[7-chloro-3-ethyl-6-(2H-tetrazol-5-yl)imidazo[1,2-a]pyridin-2-yl]-diphenylmethanol

C23H19ClN6O — CID 168740456

IUPAC[7-chloro-3-ethyl-6-(2H-tetrazol-5-yl)imidazo[1,2-a]pyridin-2-yl]-diphenylmethanol
SMILESCCc1c(C(O)(c2ccccc2)c2ccccc2)nc2cc(Cl)c(-c3nn[nH]n3)cn12
InChIInChI=1S/C23H19ClN6O/c1-2-19-21(23(31,15-9-5-3-6-10-15)16-11-7-4-8-12-16)25-20-13-18(24)17(14-30(19)20)22-26-28-29-27-22/h3-14,31H,2H2,1H3,(H,26,27,28,29)
InChIKeyRCASMVVWIKFMGZ-UHFFFAOYSA-N
MW430.90 g/mol
LogP4.01
Rot. Bonds5

About [7-chloro-3-ethyl-6-(2H-tetrazol-5-yl)imidazo[1,2-a]pyridin-2-yl]-diphenylmethanol

[7-chloro-3-ethyl-6-(2H-tetrazol-5-yl)imidazo[1,2-a]pyridin-2-yl]-diphenylmethanol (PubChem CID 168740456) has the molecular formula C23H19ClN6O and a molecular weight of 430.90 g/mol. Its IUPAC name is [7-chloro-3-ethyl-6-(2H-tetrazol-5-yl)imidazo[1,2-a]pyridin-2-yl]-diphenylmethanol.

Molecular Properties

Compound Name[7-chloro-3-ethyl-6-(2H-tetrazol-5-yl)imidazo[1,2-a]pyridin-2-yl]-diphenylmethanol
PubChem CID168740456
Molecular FormulaC23H19ClN6O
Molecular Weight430.90 g/mol
Exact Mass430.13
IUPAC Name[7-chloro-3-ethyl-6-(2H-tetrazol-5-yl)imidazo[1,2-a]pyridin-2-yl]-diphenylmethanol
SMILESCCc1c(C(O)(c2ccccc2)c2ccccc2)nc2cc(Cl)c(-c3nn[nH]n3)cn12
InChIInChI=1S/C23H19ClN6O/c1-2-19-21(23(31,15-9-5-3-6-10-15)16-11-7-4-8-12-16)25-20-13-18(24)17(14-30(19)20)22-26-28-29-27-22/h3-14,31H,2H2,1H3,(H,26,27,28,29)
InChIKeyRCASMVVWIKFMGZ-UHFFFAOYSA-N
XLogP4.01
TPSA91.99 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500430.90
LogP ≤ 54.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

[3-ethyl-7-methoxy-6-(2H-tetrazol-5-yl)imidazo[1,2-a]pyridin-2-yl]-phenyl-(1,3-thiazol-2-yl)methanol
CID 166752056
[1-ethyl-6-(2H-tetrazol-5-yl)imidazo[4,5-b]pyridin-2-yl]-diphenylmethanol
CID 156855141
[1-ethyl-5-methoxy-6-(2H-tetrazol-5-yl)imidazo[4,5-b]pyridin-2-yl]-phenyl-pyrimidin-2-ylmethanol
CID 164620295
5-(2-hydroxypropan-2-yl)-2-(methylsulfanylmethyl)-3-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]imidazole-4-carboxylic acid
CID 19036069
[1-ethyl-5-methyl-6-(2H-tetrazol-5-yl)imidazo[4,5-b]pyridin-2-yl]-bis(2-fluorophenyl)methanol
CID 168740445
5-[2-(2,2-dimethylpropyl)phenyl]-2H-tetrazole
CID 67555951
(R)-(2-ethyl-6,8-dimethylimidazo[1,2-a]pyridin-5-yl)-[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methanol
CID 57193343
[6-chloro-5-(2H-tetrazol-5-yl)imidazo[1,2-a]pyridin-2-yl]phosphonic acid
CID 19701484
6-ethyl-2-propyl-5-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]pyrazolo[1,5-b][1,2,4]triazole
CID 10693016
ethyl 5-(2-hydroxypropan-2-yl)-2-methyl-3-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]imidazole-4-carboxylate
CID 143199226
potassium;[2-butyl-5-chloro-3-[[4-phenyl-3-(2H-tetrazol-5-yl)phenyl]methyl]imidazol-4-yl]methanol;hydride
CID 173289798
2-ethyl-3-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]-1H-1,2,4-triazole-5-thione
CID 19882498

Frequently Asked Questions

What is the IUPAC name of [7-chloro-3-ethyl-6-(2H-tetrazol-5-yl)imidazo[1,2-a]pyridin-2-yl]-diphenylmethanol?
The IUPAC name of [7-chloro-3-ethyl-6-(2H-tetrazol-5-yl)imidazo[1,2-a]pyridin-2-yl]-diphenylmethanol (CID 168740456) is [7-chloro-3-ethyl-6-(2H-tetrazol-5-yl)imidazo[1,2-a]pyridin-2-yl]-diphenylmethanol.
What is the SMILES notation for [7-chloro-3-ethyl-6-(2H-tetrazol-5-yl)imidazo[1,2-a]pyridin-2-yl]-diphenylmethanol?
The canonical SMILES for [7-chloro-3-ethyl-6-(2H-tetrazol-5-yl)imidazo[1,2-a]pyridin-2-yl]-diphenylmethanol is CCc1c(C(O)(c2ccccc2)c2ccccc2)nc2cc(Cl)c(-c3nn[nH]n3)cn12.
What is the InChIKey of [7-chloro-3-ethyl-6-(2H-tetrazol-5-yl)imidazo[1,2-a]pyridin-2-yl]-diphenylmethanol?
The InChIKey is RCASMVVWIKFMGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19ClN6O/c1-2-19-21(23(31,15-9-5-3-6-10-15)16-11-7-4-8-12-16)25-20-13-18(24)17(14-30(19)20)22-26-28-29-27-22/h3-14,31H,2H2,1H3,(H,26,27,28,29).
What are the key properties of [7-chloro-3-ethyl-6-(2H-tetrazol-5-yl)imidazo[1,2-a]pyridin-2-yl]-diphenylmethanol?
[7-chloro-3-ethyl-6-(2H-tetrazol-5-yl)imidazo[1,2-a]pyridin-2-yl]-diphenylmethanol has a molecular weight of 430.90 g/mol, XLogP of 4.01, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [7-chloro-3-ethyl-6-(2H-tetrazol-5-yl)imidazo[1,2-a]pyridin-2-yl]-diphenylmethanol is sourced from PubChem (CID 168740456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).