carbanide;(2,4-dichlorophenyl)sulfonyl-methylazanide;yttrium

C8H9Cl2NO2SY-2 — CID 58436491

IUPACcarbanide;(2,4-dichlorophenyl)sulfonyl-methylazanide;yttrium
SMILESC[N-]S(=O)(=O)c1ccc(Cl)cc1Cl.[CH3-].[Y]
InChIInChI=1S/C7H6Cl2NO2S.CH3.Y/c1-10-13(11,12)7-3-2-5(8)4-6(7)9;;/h2-4H,1H3;1H3;/q2*-1;
InChIKeyPSFKHQIEWLSJTQ-UHFFFAOYSA-N
MW343.04 g/mol
LogP3.13
Rot. Bonds2

About carbanide;(2,4-dichlorophenyl)sulfonyl-methylazanide;yttrium

carbanide;(2,4-dichlorophenyl)sulfonyl-methylazanide;yttrium (PubChem CID 58436491) has the molecular formula C8H9Cl2NO2SY-2 and a molecular weight of 343.04 g/mol. Its IUPAC name is carbanide;(2,4-dichlorophenyl)sulfonyl-methylazanide;yttrium.

Molecular Properties

Compound Namecarbanide;(2,4-dichlorophenyl)sulfonyl-methylazanide;yttrium
PubChem CID58436491
Molecular FormulaC8H9Cl2NO2SY-2
Molecular Weight343.04 g/mol
Exact Mass341.88
IUPAC Namecarbanide;(2,4-dichlorophenyl)sulfonyl-methylazanide;yttrium
SMILESC[N-]S(=O)(=O)c1ccc(Cl)cc1Cl.[CH3-].[Y]
InChIInChI=1S/C7H6Cl2NO2S.CH3.Y/c1-10-13(11,12)7-3-2-5(8)4-6(7)9;;/h2-4H,1H3;1H3;/q2*-1;
InChIKeyPSFKHQIEWLSJTQ-UHFFFAOYSA-N
XLogP3.13
TPSA48.24 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.04
LogP ≤ 53.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

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Related Compounds

(2,4-dichlorophenyl)-imino-methyl-oxo-λ6-sulfane
CID 125424590
2,4-dichloro-1-propan-2-ylsulfonylbenzene
CID 22953661
(4-chlorophenyl)sulfonyl-methylazanide
CID 101403328
sodium;2,4-dichlorobenzenesulfonic acid;hydride
CID 173175851
4-(2,4-dichlorophenyl)sulfonyl-3,5-dimethyl-4H-pyrazole
CID 59823147
N-[(2,4-dichlorophenyl)-methyl-oxo-λ6-sulfanylidene]sulfamoyl chloride
CID 125424579
2,4-dichloro-N-hydroxybenzenesulfonamide
CID 83542895
carbanide;(2-chloro-6-fluorophenyl)sulfonyl-methylazanide;yttrium
CID 58436484
2,4-dichloro-N-(2-oxoethyl)benzenesulfonamide
CID 143489858
2,4-dichloro-N-[2-[(2,4-dichlorophenyl)sulfonylamino]phenyl]benzenesulfonamide
CID 70137943
sulfuryl dichloride;1,2,4-trichlorobenzene
CID 77134549
1-(2,4-dichlorophenyl)sulfonylimidazole
CID 4914608

Frequently Asked Questions

What is the IUPAC name of carbanide;(2,4-dichlorophenyl)sulfonyl-methylazanide;yttrium?
The IUPAC name of carbanide;(2,4-dichlorophenyl)sulfonyl-methylazanide;yttrium (CID 58436491) is carbanide;(2,4-dichlorophenyl)sulfonyl-methylazanide;yttrium.
What is the SMILES notation for carbanide;(2,4-dichlorophenyl)sulfonyl-methylazanide;yttrium?
The canonical SMILES for carbanide;(2,4-dichlorophenyl)sulfonyl-methylazanide;yttrium is C[N-]S(=O)(=O)c1ccc(Cl)cc1Cl.[CH3-].[Y].
What is the InChIKey of carbanide;(2,4-dichlorophenyl)sulfonyl-methylazanide;yttrium?
The InChIKey is PSFKHQIEWLSJTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6Cl2NO2S.CH3.Y/c1-10-13(11,12)7-3-2-5(8)4-6(7)9;;/h2-4H,1H3;1H3;/q2*-1;.
What are the key properties of carbanide;(2,4-dichlorophenyl)sulfonyl-methylazanide;yttrium?
carbanide;(2,4-dichlorophenyl)sulfonyl-methylazanide;yttrium has a molecular weight of 343.04 g/mol, XLogP of 3.13, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for carbanide;(2,4-dichlorophenyl)sulfonyl-methylazanide;yttrium is sourced from PubChem (CID 58436491), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).