N-[3-{4-[(Diaminomethylene)Amino]Phenyl}-1-Oxo-1-(1-Piperidinyl)-2-Propanyl]-4-Methylbenzenesulfonamide
Properties
Property | Value |
---|---|
Formula | C22H29N5O3S |
IUPAC Name | 2-[4-[(2r)-3-oxo-3-(1-piperidyl)-2-(p-tolylsulfonylamino)propyl]phenyl]guanidine |
Molecular Mass | 443.562 g·mol−1 |
Heat of Formation | -384.1 ± 16.7 kJ·mol−1 |
Dipole Moment | 6.69 ± 1.08 D |
Volume | 536.15 Å 3 |
Surface Area | 402.73 Å 2 |
HOMO Energy | -8.92 ± 0.55 eV |
LUMO Energy | -0.57 ± eV |
Point Group Symmetry | C1 |
InChIKey | NITXQGQPZACTDF-HXUWFJFHSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H S C O N |