(dimethyl-λ4-sulfanylidene)-dihydroxy-(1,3,5-triazin-2-yloxy)-λ5-phosphane

C5H10N3O3PS — CID 88510217

IUPAC(dimethyl-λ4-sulfanylidene)-dihydroxy-(1,3,5-triazin-2-yloxy)-λ5-phosphane
SMILESCS(C)=P(O)(O)Oc1ncncn1
InChIInChI=1S/C5H10N3O3PS/c1-13(2)12(9,10)11-5-7-3-6-4-8-5/h3-4,9-10H,1-2H3
InChIKeyVWZWTMRLBRNPDK-UHFFFAOYSA-N
MW223.19 g/mol
LogP-0.21
Rot. Bonds2

About (dimethyl-λ4-sulfanylidene)-dihydroxy-(1,3,5-triazin-2-yloxy)-λ5-phosphane

(dimethyl-λ4-sulfanylidene)-dihydroxy-(1,3,5-triazin-2-yloxy)-λ5-phosphane (PubChem CID 88510217) has the molecular formula C5H10N3O3PS and a molecular weight of 223.19 g/mol. Its IUPAC name is (dimethyl-λ4-sulfanylidene)-dihydroxy-(1,3,5-triazin-2-yloxy)-λ5-phosphane.

Molecular Properties

Compound Name(dimethyl-λ4-sulfanylidene)-dihydroxy-(1,3,5-triazin-2-yloxy)-λ5-phosphane
PubChem CID88510217
Molecular FormulaC5H10N3O3PS
Molecular Weight223.19 g/mol
Exact Mass223.02
IUPAC Name(dimethyl-λ4-sulfanylidene)-dihydroxy-(1,3,5-triazin-2-yloxy)-λ5-phosphane
SMILESCS(C)=P(O)(O)Oc1ncncn1
InChIInChI=1S/C5H10N3O3PS/c1-13(2)12(9,10)11-5-7-3-6-4-8-5/h3-4,9-10H,1-2H3
InChIKeyVWZWTMRLBRNPDK-UHFFFAOYSA-N
XLogP-0.21
TPSA88.36 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.19
LogP ≤ 5-0.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze (dimethyl-λ4-sulfanylidene)-dihydroxy-(1,3,5-triazin-2-yloxy)-λ5-phosphane with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (dimethyl-λ4-sulfanylidene)-dihydroxy-(1,3,5-triazin-2-yloxy)-λ5-phosphane?
The IUPAC name of (dimethyl-λ4-sulfanylidene)-dihydroxy-(1,3,5-triazin-2-yloxy)-λ5-phosphane (CID 88510217) is (dimethyl-λ4-sulfanylidene)-dihydroxy-(1,3,5-triazin-2-yloxy)-λ5-phosphane.
What is the SMILES notation for (dimethyl-λ4-sulfanylidene)-dihydroxy-(1,3,5-triazin-2-yloxy)-λ5-phosphane?
The canonical SMILES for (dimethyl-λ4-sulfanylidene)-dihydroxy-(1,3,5-triazin-2-yloxy)-λ5-phosphane is CS(C)=P(O)(O)Oc1ncncn1.
What is the InChIKey of (dimethyl-λ4-sulfanylidene)-dihydroxy-(1,3,5-triazin-2-yloxy)-λ5-phosphane?
The InChIKey is VWZWTMRLBRNPDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10N3O3PS/c1-13(2)12(9,10)11-5-7-3-6-4-8-5/h3-4,9-10H,1-2H3.
What are the key properties of (dimethyl-λ4-sulfanylidene)-dihydroxy-(1,3,5-triazin-2-yloxy)-λ5-phosphane?
(dimethyl-λ4-sulfanylidene)-dihydroxy-(1,3,5-triazin-2-yloxy)-λ5-phosphane has a molecular weight of 223.19 g/mol, XLogP of -0.21, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (dimethyl-λ4-sulfanylidene)-dihydroxy-(1,3,5-triazin-2-yloxy)-λ5-phosphane is sourced from PubChem (CID 88510217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).