N,N-dimethyl-4-(5-methylsulfanyltetrazol-1-yl)benzenesulfonamide

C10H13N5O2S2 — CID 6460609

IUPACN,N-dimethyl-4-(5-methylsulfanyltetrazol-1-yl)benzenesulfonamide
SMILESCSc1nnnn1-c1ccc(S(=O)(=O)N(C)C)cc1
InChIInChI=1S/C10H13N5O2S2/c1-14(2)19(16,17)9-6-4-8(5-7-9)15-10(18-3)11-12-13-15/h4-7H,1-3H3
InChIKeyNWBJSTMQIJIGJE-UHFFFAOYSA-N
MW299.38 g/mol
LogP0.63
Rot. Bonds4

About N,N-dimethyl-4-(5-methylsulfanyltetrazol-1-yl)benzenesulfonamide

N,N-dimethyl-4-(5-methylsulfanyltetrazol-1-yl)benzenesulfonamide (PubChem CID 6460609) has the molecular formula C10H13N5O2S2 and a molecular weight of 299.38 g/mol. Its IUPAC name is N,N-dimethyl-4-(5-methylsulfanyltetrazol-1-yl)benzenesulfonamide.

Molecular Properties

Compound NameN,N-dimethyl-4-(5-methylsulfanyltetrazol-1-yl)benzenesulfonamide
PubChem CID6460609
Molecular FormulaC10H13N5O2S2
Molecular Weight299.38 g/mol
Exact Mass299.05
IUPAC NameN,N-dimethyl-4-(5-methylsulfanyltetrazol-1-yl)benzenesulfonamide
SMILESCSc1nnnn1-c1ccc(S(=O)(=O)N(C)C)cc1
InChIInChI=1S/C10H13N5O2S2/c1-14(2)19(16,17)9-6-4-8(5-7-9)15-10(18-3)11-12-13-15/h4-7H,1-3H3
InChIKeyNWBJSTMQIJIGJE-UHFFFAOYSA-N
XLogP0.63
TPSA80.98 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.38
LogP ≤ 50.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze N,N-dimethyl-4-(5-methylsulfanyltetrazol-1-yl)benzenesulfonamide 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

N-[4-(dimethylsulfamoyl)phenyl]-2-[1-(4-methoxyphenyl)tetrazol-5-yl]sulfanylacetamide
CID 3340473
N-[2-chloro-5-(dimethylsulfamoyl)phenyl]-2-[1-(4-hydroxyphenyl)tetrazol-5-yl]sulfanylacetamide
CID 4216270
2-[1-(4-methylsulfonylphenyl)tetrazol-5-yl]sulfanylacetic acid
CID 29070462
N-[5-(dimethylsulfamoyl)-2-methoxyphenyl]-2-[1-(4-methoxyphenyl)tetrazol-5-yl]sulfanylacetamide
CID 4238077
N-[[4-(dimethylsulfamoyl)phenyl]methyl]-4-(5-methyltetrazol-1-yl)benzamide
CID 46974468
3-[4-(diethylsulfamoyl)phenyl]-N-[3-(5-methylsulfanyltetrazol-1-yl)phenyl]propanamide
CID 55609222
N-(4-methylphenyl)-4-(5-methylsulfanyltetrazol-1-yl)benzamide
CID 46377491
N-[4-(diethylsulfamoyl)phenyl]-2-[1-(4-hydroxyphenyl)tetrazol-5-yl]sulfanylacetamide
CID 2109822
N,N-dimethyl-6-oxo-1-[(1-phenyltetrazol-5-yl)methyl]pyridine-3-sulfonamide
CID 26963100
CID 90391328
CID 90391328
4-(5-methylsulfonylsulfanyltetrazol-1-yl)benzoic acid
CID 18731462
4-[5-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]tetrazol-1-yl]benzenesulfonamide
CID 18708014

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-4-(5-methylsulfanyltetrazol-1-yl)benzenesulfonamide?
The IUPAC name of N,N-dimethyl-4-(5-methylsulfanyltetrazol-1-yl)benzenesulfonamide (CID 6460609) is N,N-dimethyl-4-(5-methylsulfanyltetrazol-1-yl)benzenesulfonamide.
What is the SMILES notation for N,N-dimethyl-4-(5-methylsulfanyltetrazol-1-yl)benzenesulfonamide?
The canonical SMILES for N,N-dimethyl-4-(5-methylsulfanyltetrazol-1-yl)benzenesulfonamide is CSc1nnnn1-c1ccc(S(=O)(=O)N(C)C)cc1.
What is the InChIKey of N,N-dimethyl-4-(5-methylsulfanyltetrazol-1-yl)benzenesulfonamide?
The InChIKey is NWBJSTMQIJIGJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N5O2S2/c1-14(2)19(16,17)9-6-4-8(5-7-9)15-10(18-3)11-12-13-15/h4-7H,1-3H3.
What are the key properties of N,N-dimethyl-4-(5-methylsulfanyltetrazol-1-yl)benzenesulfonamide?
N,N-dimethyl-4-(5-methylsulfanyltetrazol-1-yl)benzenesulfonamide has a molecular weight of 299.38 g/mol, XLogP of 0.63, 4 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-4-(5-methylsulfanyltetrazol-1-yl)benzenesulfonamide is sourced from PubChem (CID 6460609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).