5-(6-chloro-5-methyl-1H-indol-2-yl)-3-(1-methylindazol-6-yl)-1,2,4-oxadiazole

C19H14ClN5O — CID 167835927

IUPAC5-(6-chloro-5-methyl-1H-indol-2-yl)-3-(1-methylindazol-6-yl)-1,2,4-oxadiazole
SMILESCc1cc2cc(-c3nc(-c4ccc5cnn(C)c5c4)no3)[nH]c2cc1Cl
InChIInChI=1S/C19H14ClN5O/c1-10-5-13-6-16(22-15(13)8-14(10)20)19-23-18(24-26-19)11-3-4-12-9-21-25(2)17(12)7-11/h3-9,22H,1-2H3
InChIKeyBYFDYSGZXJWUOK-UHFFFAOYSA-N
MW363.81 g/mol
LogP4.73
Rot. Bonds2

About 5-(6-chloro-5-methyl-1H-indol-2-yl)-3-(1-methylindazol-6-yl)-1,2,4-oxadiazole

5-(6-chloro-5-methyl-1H-indol-2-yl)-3-(1-methylindazol-6-yl)-1,2,4-oxadiazole (PubChem CID 167835927) has the molecular formula C19H14ClN5O and a molecular weight of 363.81 g/mol. Its IUPAC name is 5-(6-chloro-5-methyl-1H-indol-2-yl)-3-(1-methylindazol-6-yl)-1,2,4-oxadiazole.

Molecular Properties

Compound Name5-(6-chloro-5-methyl-1H-indol-2-yl)-3-(1-methylindazol-6-yl)-1,2,4-oxadiazole
PubChem CID167835927
Molecular FormulaC19H14ClN5O
Molecular Weight363.81 g/mol
Exact Mass363.09
IUPAC Name5-(6-chloro-5-methyl-1H-indol-2-yl)-3-(1-methylindazol-6-yl)-1,2,4-oxadiazole
SMILESCc1cc2cc(-c3nc(-c4ccc5cnn(C)c5c4)no3)[nH]c2cc1Cl
InChIInChI=1S/C19H14ClN5O/c1-10-5-13-6-16(22-15(13)8-14(10)20)19-23-18(24-26-19)11-3-4-12-9-21-25(2)17(12)7-11/h3-9,22H,1-2H3
InChIKeyBYFDYSGZXJWUOK-UHFFFAOYSA-N
XLogP4.73
TPSA72.53 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.81
LogP ≤ 54.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-(3,5-dichloro-1H-indol-2-yl)-3-(1-methylindazol-6-yl)-1,2,4-oxadiazole
CID 167933054
5-chloro-1,6-dimethylindazole
CID 84657674
cyclopropyl-[3-[3-(1-methylindazol-6-yl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl]methanone
CID 127868766
5-(3-chloro-4-methylphenyl)-3-(4-methylphenyl)-1,2,4-oxadiazole
CID 931247
4-methyl-2-(1-methylindazol-6-yl)-1,3-thiazole
CID 166386367
6-chloro-2-(1-methylindazol-6-yl)-1,3-benzoxazole
CID 139379765
5-(1-methylindazol-6-yl)-1,2-oxazole-3-carboxylic acid
CID 117359203
4-[3-(1-methylindazol-6-yl)-1,2,4-oxadiazol-5-yl]-N-phenylpiperidine-1-carboxamide
CID 139003901
N-[4-[5-(5-chloro-1H-indol-2-yl)-1,2,4-oxadiazol-3-yl]phenyl]methanesulfonamide
CID 135964979
5-[5-(4-fluoro-6-methyl-1H-indol-2-yl)-1,2,4-oxadiazol-3-yl]-1H-pyridin-2-one
CID 167759131
7-methyl-4-(1-methylindazol-6-yl)-2,3-dihydroisoindol-1-one
CID 162528335
2-(3-phenyl-1,2,4-oxadiazol-5-yl)-1H-indol-5-ol
CID 135894697

Frequently Asked Questions

What is the IUPAC name of 5-(6-chloro-5-methyl-1H-indol-2-yl)-3-(1-methylindazol-6-yl)-1,2,4-oxadiazole?
The IUPAC name of 5-(6-chloro-5-methyl-1H-indol-2-yl)-3-(1-methylindazol-6-yl)-1,2,4-oxadiazole (CID 167835927) is 5-(6-chloro-5-methyl-1H-indol-2-yl)-3-(1-methylindazol-6-yl)-1,2,4-oxadiazole.
What is the SMILES notation for 5-(6-chloro-5-methyl-1H-indol-2-yl)-3-(1-methylindazol-6-yl)-1,2,4-oxadiazole?
The canonical SMILES for 5-(6-chloro-5-methyl-1H-indol-2-yl)-3-(1-methylindazol-6-yl)-1,2,4-oxadiazole is Cc1cc2cc(-c3nc(-c4ccc5cnn(C)c5c4)no3)[nH]c2cc1Cl.
What is the InChIKey of 5-(6-chloro-5-methyl-1H-indol-2-yl)-3-(1-methylindazol-6-yl)-1,2,4-oxadiazole?
The InChIKey is BYFDYSGZXJWUOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14ClN5O/c1-10-5-13-6-16(22-15(13)8-14(10)20)19-23-18(24-26-19)11-3-4-12-9-21-25(2)17(12)7-11/h3-9,22H,1-2H3.
What are the key properties of 5-(6-chloro-5-methyl-1H-indol-2-yl)-3-(1-methylindazol-6-yl)-1,2,4-oxadiazole?
5-(6-chloro-5-methyl-1H-indol-2-yl)-3-(1-methylindazol-6-yl)-1,2,4-oxadiazole has a molecular weight of 363.81 g/mol, XLogP of 4.73, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(6-chloro-5-methyl-1H-indol-2-yl)-3-(1-methylindazol-6-yl)-1,2,4-oxadiazole is sourced from PubChem (CID 167835927), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).