| CAS Number | 1630936-95-6 |
| Catalog Number | AG01E2K8 |
| Chemical Name | VU0422288 |
| IUPAC Name | N-[3-chloro-4-(5-chloropyridin-2-yl)oxyphenyl]pyridine-2-carboxamide |
| InChI | InChI=1S/C17H11Cl2N3O2/c18-11-4-7-16(21-10-11)24-15-6-5-12(9-13(15)19)22-17(23)14-3-1-2-8-20-14/h1-10H,(H,22,23) |
| InChI Key | MZRLPXFGQKQHST-UHFFFAOYSA-N |
| MDL Number | MFCD28411626 |
| Molecular Formula | C17H11Cl2N3O2 |
| Molecular Weight | 360.1941 |
| SMILES | O=C(C1=CC=CC=N1)NC2=CC(Cl)=C(C=C2)OC3=CC=C(Cl)C=N3 |
| Synonyms | ML396 compound,
VU0422288,
VU 0422288,
1630936-95-6,
ML 396,
VU0422288,
ML396,
SCHEMBL20166019,
GTPL10239,
ML-396,
AKOS025293496,
ZINC208398371,
ML396, >=98% (HPLC),
VU-0422288,
VU0422288-4,
N-(3-chloro-4-((5-chloropyridin-2-yl)oxy)phenyl)picolinamide,
N-[3-Chloro-4-[(5-chloro-2-pyridinyl)oxy]phenyl]-2-pyridinecarboxamide,
N-{3-CHLORO-4-[(5-CHLOROPYRIDIN-2-YL)OXY]PHENYL}PYRIDINE-2-CARBOXAMIDE,
MZRLPXFGQKQHST-UHFFFAOYSA-N,
|
| Complexity | 427 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 359.023g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 24 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 360.194g/mol |
| Monoisotopic Mass | 359.023g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 64.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 4.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number