1-(5-Isopropyl-1,2,4-oxadiazol-3-yl)-N-methylmethanamine - CAS 938459-06-4
Catalog: |
BB041108 |
Product Name: |
1-(5-Isopropyl-1,2,4-oxadiazol-3-yl)-N-methylmethanamine |
CAS: |
938459-06-4 |
Synonyms: |
N-methyl-1-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methanamine |
IUPAC Name: | N-methyl-1-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methanamine |
Description: | 1-(5-Isopropyl-1,2,4-oxadiazol-3-yl)-N-methylmethanamine (CAS# 938459-06-4) is a useful research chemical. |
Molecular Weight: | 155.20 |
Molecular Formula: | C7H13N3O |
Canonical SMILES: | CC(C)C1=NC(=NO1)CNC |
InChI: | InChI=1S/C7H13N3O/c1-5(2)7-9-6(4-8-3)10-11-7/h5,8H,4H2,1-3H3 |
InChI Key: | VQKNAAAIDMNTME-UHFFFAOYSA-N |
Boiling Point: | 235.3 °C at 760 mmHg |
Density: | 1.032 g/cm3 |
LogP: | 1.30330 |
Publication Number | Title | Priority Date |
EP-3016951-B1 | Tricyclic pyrido-carboxamide derivatives as rock inhibitors | 20130702 |
US-2016152628-A1 | Tricyclic pyrido-carboxamide derivatives as rock inhibitors | 20130702 |
US-9580392-B2 | HIV replication inhibiting pyrimidines | 20010813 |
Complexity: | 118 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 155.105862047 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 155.105862047 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 51 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.7 |
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