Input interpretation
thiotepa | mepivacaine
Chemical names and formulas
| thiotepa | mepivacaine formula | C_6H_12N_3PS | C_15H_22N_2O Hill formula | C_6H_12N_3PS | C_15H_22N_2O name | thiotepa | mepivacaine IUPAC name | tris(aziridin-1-yl)-sulfanylidene-phosphorane | N-(2, 6-dimethylphenyl)-1-methylpiperidine-2-carboxamide alternate names | tespamin | thiophosphamide | triethylenethiophosphoramide | tris(aziridinyl)phosphine sulfide | (none) mass fractions | C (carbon) 38.1% | H (hydrogen) 6.39% | N (nitrogen) 22.2% | P (phosphorus) 16.4% | S (sulfur) 16.9% | C (carbon) 73.1% | H (hydrogen) 9% | N (nitrogen) 11.4% | O (oxygen) 6.49%
Structure diagrams
| thiotepa | mepivacaine vertex count | 11 | 18 edge count | 13 | 20 Schultz index | 694 | 2566 Wiener index | 139 | 609 Hosoya index | 224 | 4732 Balaban index | 1.821 | 1.902
3D structure
3D structure
Basic properties
| thiotepa | mepivacaine molar mass | 189.22 g/mol | 246.35 g/mol phase | solid (at STP) | solid (at STP) melting point | 51 °C | 150.5 °C boiling point | 270 °C |
Units
Hydrophobicity and permeability properties
| mepivacaine experimental LogP hydrophobicity | 2.2 predicted LogP hydrophobicity | 2.16 experimental LogS | -1.55 predicted LogS | -2.6