(7R)-N-(4-chlorophenyl)-5-methyl-7-pyridin-3-yl-4,7-dihydrotetrazolo[1,5-a]pyrimidine-6-carboxamide
Formula:C17H14N7OCl
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(7R)-N-(4-chlorophenyl)-5-methyl-7-pyridin-3-yl-4,7-dihydrotetrazolo[1,5-a]pyrimidine-6-carboxamide is a drug-like molecule.
| MolName | (7R)-N-(4-chlorophenyl)-5-methyl-7-pyridin-3-yl-4,7-dihydrotetrazolo[1,5-a]pyrimidine-6-carboxamide |
| MolecularFormula | C17H14N7OCl |
| Smiles | CC(Nc1nnnn1[C@@H]1c2cnccc2)=C1C(Nc(cc1)ccc1Cl)=O |
| InChI | InChI=1S/C17H14ClN7O/c1-10-14(16(26)21-13-6-4-12(18)5-7-13)15(11-3-2-8-19-9-11)25-17(20-10)22-23-24-25/h2-9,15H,1H3,(H,21,26)(H,20,22,24)/t15-/m1/s1 |
| InChIK | SVIKUTPZBPHEIO-OAHLLOKOSA-N |
| TotalMolweight | 367.799 |
| Molweight | 367.799 |
| MonoisotopicMass | 367.094835 |
| CLogP | 2.2587 |
| CLogS | -5.582 |
| H Acceptors | 8 |
| H Donors | 2 |
| TotalSurfaceArea | 267.29 |
| Relative PSA | 0.3244 |
| PolarSurfaceArea | 97.62 |
| Druglikeness | 3.8906 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.5 |
| Fragments | 1 |
| Non HAtoms | 26 |
| NonCHAtoms | 9 |
| Electronegative Atoms | 9 |
| StereoCenters | 1 |
| Rotatable Bond | 3 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 17 |
| Sp3Atoms | 2 |
| Symmetricatoms | 2 |
| Amides | 1 |
| Aromatic Nitrogens | 5 |
| StereoCon | this enantiomer |
Click to Load Molecule:
1 - (7R)-N-(4-chlorophenyl)-5-methyl-7-pyridin-3-yl-4,7-dihydrotetrazolo[1,5-a]pyrimidine-6-carboxamide | 2 - (7R)-N-(4-chlorophenyl)-5-methyl-7-pyridin-3-yl-4,7-dihydrotetrazolo[1,5-a]pyrimidine-6-carboxamide
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