3-[[5-(2-chlorophenyl)tetrazol-2-yl]methyl]-5-(furan-2-yl)-1,2-oxazole

C15H10ClN5O2 — CID 8685721

IUPAC3-[[5-(2-chlorophenyl)tetrazol-2-yl]methyl]-5-(furan-2-yl)-1,2-oxazole
SMILESClc1ccccc1-c1nnn(Cc2cc(-c3ccco3)on2)n1
InChIInChI=1S/C15H10ClN5O2/c16-12-5-2-1-4-11(12)15-17-20-21(18-15)9-10-8-14(23-19-10)13-6-3-7-22-13/h1-8H,9H2
InChIKeyNMBVVLYILLAUMS-UHFFFAOYSA-N
MW327.73 g/mol
LogP3.29
Rot. Bonds4

About 3-[[5-(2-chlorophenyl)tetrazol-2-yl]methyl]-5-(furan-2-yl)-1,2-oxazole

3-[[5-(2-chlorophenyl)tetrazol-2-yl]methyl]-5-(furan-2-yl)-1,2-oxazole (PubChem CID 8685721) has the molecular formula C15H10ClN5O2 and a molecular weight of 327.73 g/mol. Its IUPAC name is 3-[[5-(2-chlorophenyl)tetrazol-2-yl]methyl]-5-(furan-2-yl)-1,2-oxazole.

Molecular Properties

Compound Name3-[[5-(2-chlorophenyl)tetrazol-2-yl]methyl]-5-(furan-2-yl)-1,2-oxazole
PubChem CID8685721
Molecular FormulaC15H10ClN5O2
Molecular Weight327.73 g/mol
Exact Mass327.05
IUPAC Name3-[[5-(2-chlorophenyl)tetrazol-2-yl]methyl]-5-(furan-2-yl)-1,2-oxazole
SMILESClc1ccccc1-c1nnn(Cc2cc(-c3ccco3)on2)n1
InChIInChI=1S/C15H10ClN5O2/c16-12-5-2-1-4-11(12)15-17-20-21(18-15)9-10-8-14(23-19-10)13-6-3-7-22-13/h1-8H,9H2
InChIKeyNMBVVLYILLAUMS-UHFFFAOYSA-N
XLogP3.29
TPSA82.77 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.73
LogP ≤ 53.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 3-[[5-(2-chlorophenyl)tetrazol-2-yl]methyl]-5-(furan-2-yl)-1,2-oxazole with MolForge

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

Launch Full Analysis

Related Compounds

2-benzyl-5-(2-chlorophenyl)tetrazole
CID 4809386
3-[[5-(2-bromophenyl)tetrazol-2-yl]methyl]-5-thiophen-2-yl-1,2-oxazole
CID 8809937
5-(2-chlorophenyl)-2-[(3-methylphenyl)methyl]tetrazole
CID 7702797
5-(2-chlorophenyl)-2-(2-phenylethyl)tetrazole
CID 8685521
2-[(2-chloro-6-fluorophenyl)methyl]-5-(2-chlorophenyl)tetrazole
CID 4809389
3-[[5-(4-bromophenyl)tetrazol-2-yl]methyl]-5-phenyl-1,2-oxazole
CID 8598063
[5-(furan-2-yl)-1,2-oxazol-3-yl]methanamine
CID 7060533
5-phenyl-3-[[5-(4-propan-2-ylphenyl)tetrazol-2-yl]methyl]-1,2-oxazole
CID 8643026
2-[(6-chloro-4H-1,3-benzodioxin-8-yl)methyl]-5-(2-chlorophenyl)tetrazole
CID 7564478
3-[[4-[(5-chlorothiophen-2-yl)methyl]piperazin-1-yl]methyl]-5-(furan-2-yl)-1,2-oxazole
CID 8617759
3-[[4-(2-bromoethyl)triazol-1-yl]methyl]-5-(furan-2-yl)-1,2-oxazole
CID 55071636
[5-(furan-2-yl)-1,2-oxazol-3-yl]methanamine;hydrochloride
CID 53398902

Frequently Asked Questions

What is the IUPAC name of 3-[[5-(2-chlorophenyl)tetrazol-2-yl]methyl]-5-(furan-2-yl)-1,2-oxazole?
The IUPAC name of 3-[[5-(2-chlorophenyl)tetrazol-2-yl]methyl]-5-(furan-2-yl)-1,2-oxazole (CID 8685721) is 3-[[5-(2-chlorophenyl)tetrazol-2-yl]methyl]-5-(furan-2-yl)-1,2-oxazole.
What is the SMILES notation for 3-[[5-(2-chlorophenyl)tetrazol-2-yl]methyl]-5-(furan-2-yl)-1,2-oxazole?
The canonical SMILES for 3-[[5-(2-chlorophenyl)tetrazol-2-yl]methyl]-5-(furan-2-yl)-1,2-oxazole is Clc1ccccc1-c1nnn(Cc2cc(-c3ccco3)on2)n1.
What is the InChIKey of 3-[[5-(2-chlorophenyl)tetrazol-2-yl]methyl]-5-(furan-2-yl)-1,2-oxazole?
The InChIKey is NMBVVLYILLAUMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10ClN5O2/c16-12-5-2-1-4-11(12)15-17-20-21(18-15)9-10-8-14(23-19-10)13-6-3-7-22-13/h1-8H,9H2.
What are the key properties of 3-[[5-(2-chlorophenyl)tetrazol-2-yl]methyl]-5-(furan-2-yl)-1,2-oxazole?
3-[[5-(2-chlorophenyl)tetrazol-2-yl]methyl]-5-(furan-2-yl)-1,2-oxazole has a molecular weight of 327.73 g/mol, XLogP of 3.29, 4 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[5-(2-chlorophenyl)tetrazol-2-yl]methyl]-5-(furan-2-yl)-1,2-oxazole is sourced from PubChem (CID 8685721), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).