N-carbamoyl-3-thieno[3,2-d]pyrimidin-4-ylsulfanylpropanamide

C10H10N4O2S2 — CID 18274708

IUPACN-carbamoyl-3-thieno[3,2-d]pyrimidin-4-ylsulfanylpropanamide
SMILESNC(=O)NC(=O)CCSc1ncnc2ccsc12
InChIInChI=1S/C10H10N4O2S2/c11-10(16)14-7(15)2-4-18-9-8-6(1-3-17-8)12-5-13-9/h1,3,5H,2,4H2,(H3,11,14,15,16)
InChIKeyGRPKLUILTJBPJZ-UHFFFAOYSA-N
MW282.35 g/mol
LogP1.37
Rot. Bonds4

About N-carbamoyl-3-thieno[3,2-d]pyrimidin-4-ylsulfanylpropanamide

N-carbamoyl-3-thieno[3,2-d]pyrimidin-4-ylsulfanylpropanamide (PubChem CID 18274708) has the molecular formula C10H10N4O2S2 and a molecular weight of 282.35 g/mol. Its IUPAC name is N-carbamoyl-3-thieno[3,2-d]pyrimidin-4-ylsulfanylpropanamide.

Molecular Properties

Compound NameN-carbamoyl-3-thieno[3,2-d]pyrimidin-4-ylsulfanylpropanamide
PubChem CID18274708
Molecular FormulaC10H10N4O2S2
Molecular Weight282.35 g/mol
Exact Mass282.02
IUPAC NameN-carbamoyl-3-thieno[3,2-d]pyrimidin-4-ylsulfanylpropanamide
SMILESNC(=O)NC(=O)CCSc1ncnc2ccsc12
InChIInChI=1S/C10H10N4O2S2/c11-10(16)14-7(15)2-4-18-9-8-6(1-3-17-8)12-5-13-9/h1,3,5H,2,4H2,(H3,11,14,15,16)
InChIKeyGRPKLUILTJBPJZ-UHFFFAOYSA-N
XLogP1.37
TPSA97.97 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.35
LogP ≤ 51.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze N-carbamoyl-3-thieno[3,2-d]pyrimidin-4-ylsulfanylpropanamide 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 N-carbamoyl-3-thieno[3,2-d]pyrimidin-4-ylsulfanylpropanamide?
The IUPAC name of N-carbamoyl-3-thieno[3,2-d]pyrimidin-4-ylsulfanylpropanamide (CID 18274708) is N-carbamoyl-3-thieno[3,2-d]pyrimidin-4-ylsulfanylpropanamide.
What is the SMILES notation for N-carbamoyl-3-thieno[3,2-d]pyrimidin-4-ylsulfanylpropanamide?
The canonical SMILES for N-carbamoyl-3-thieno[3,2-d]pyrimidin-4-ylsulfanylpropanamide is NC(=O)NC(=O)CCSc1ncnc2ccsc12.
What is the InChIKey of N-carbamoyl-3-thieno[3,2-d]pyrimidin-4-ylsulfanylpropanamide?
The InChIKey is GRPKLUILTJBPJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N4O2S2/c11-10(16)14-7(15)2-4-18-9-8-6(1-3-17-8)12-5-13-9/h1,3,5H,2,4H2,(H3,11,14,15,16).
What are the key properties of N-carbamoyl-3-thieno[3,2-d]pyrimidin-4-ylsulfanylpropanamide?
N-carbamoyl-3-thieno[3,2-d]pyrimidin-4-ylsulfanylpropanamide has a molecular weight of 282.35 g/mol, XLogP of 1.37, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-carbamoyl-3-thieno[3,2-d]pyrimidin-4-ylsulfanylpropanamide is sourced from PubChem (CID 18274708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).