Pd173955
Properties
- Molecular formula
- C21H16Cl2N4OS
- Molar mass
- 443.35 g/mol
- Exact mass
- 442.0422 Da
- logP
- 5.77Crippen estimate
- Polar surface area
- 59.8 Ų
- H-bond donors / acceptors
- 1 / 5
- Rotatable bonds
- 4
Hazards
No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library
Identifiers
CAS number
260415-63-2SMILES
CN1C2=NC(=NC=C2C=C(C1=O)C3=C(C=CC=C3Cl)Cl)NC4=CC(=CC=C4)SCInChIKey
VAARYSWULJUGST-UHFFFAOYSA-NInChI
InChI=1S/C21H16Cl2N4OS/c1-27-19-12(9-15(20(27)28)18-16(22)7-4-8-17(18)23)11-24-21(26-19)25-13-5-3-6-14(10-13)29-2/h3-11H,1-2H3,(H,24,25,26)Weigh it out
Type any one amount. The others follow from the molar mass.