2-diaminophosphinothioylsulfanylthiophene

C4H7N2PS3 — CID 57304969

IUPAC2-diaminophosphinothioylsulfanylthiophene
SMILESNP(N)(=S)Sc1cccs1
InChIInChI=1S/C4H7N2PS3/c5-7(6,8)10-4-2-1-3-9-4/h1-3H,(H4,5,6,8)
InChIKeyMRIDKWJDSMZKRQ-UHFFFAOYSA-N
MW210.29 g/mol
LogP1.98
Rot. Bonds2

About 2-diaminophosphinothioylsulfanylthiophene

2-diaminophosphinothioylsulfanylthiophene (PubChem CID 57304969) has the molecular formula C4H7N2PS3 and a molecular weight of 210.29 g/mol. Its IUPAC name is 2-diaminophosphinothioylsulfanylthiophene.

Molecular Properties

Compound Name2-diaminophosphinothioylsulfanylthiophene
PubChem CID57304969
Molecular FormulaC4H7N2PS3
Molecular Weight210.29 g/mol
Exact Mass209.95
IUPAC Name2-diaminophosphinothioylsulfanylthiophene
SMILESNP(N)(=S)Sc1cccs1
InChIInChI=1S/C4H7N2PS3/c5-7(6,8)10-4-2-1-3-9-4/h1-3H,(H4,5,6,8)
InChIKeyMRIDKWJDSMZKRQ-UHFFFAOYSA-N
XLogP1.98
TPSA52.04 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.29
LogP ≤ 51.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-diaminophosphinothioylsulfanylthiophene?
The IUPAC name of 2-diaminophosphinothioylsulfanylthiophene (CID 57304969) is 2-diaminophosphinothioylsulfanylthiophene.
What is the SMILES notation for 2-diaminophosphinothioylsulfanylthiophene?
The canonical SMILES for 2-diaminophosphinothioylsulfanylthiophene is NP(N)(=S)Sc1cccs1.
What is the InChIKey of 2-diaminophosphinothioylsulfanylthiophene?
The InChIKey is MRIDKWJDSMZKRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H7N2PS3/c5-7(6,8)10-4-2-1-3-9-4/h1-3H,(H4,5,6,8).
What are the key properties of 2-diaminophosphinothioylsulfanylthiophene?
2-diaminophosphinothioylsulfanylthiophene has a molecular weight of 210.29 g/mol, XLogP of 1.98, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-diaminophosphinothioylsulfanylthiophene is sourced from PubChem (CID 57304969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).