| CAS Number | 439861-56-0 |
| Catalog Number | AG00DGSN(AGN-PC-0MV495) |
| Chemical Name | NPY5RA-972 |
| IUPAC Name | N-(4-methyl-9-propan-2-ylcarbazol-3-yl)morpholine-4-carboxamide |
| InChI | InChI=1S/C21H25N3O2/c1-14(2)24-18-7-5-4-6-16(18)20-15(3)17(8-9-19(20)24)22-21(25)23-10-12-26-13-11-23/h4-9,14H,10-13H2,1-3H3,(H,22,25) |
| InChI Key | ZNFMHLDBJPAFEQ-UHFFFAOYSA-N |
| MDL Number | MFCD16618400 |
| Molecular Formula | C21H25N3O2 |
| Molecular Weight | 351.4421 |
| SMILES | O=C(N1CCOCC1)NC1=C(C)C2C3C(N(C(C)C)C=2C=C1)=CC=CC=3 |
| Synonyms | NPY 5RA972,
439861-56-0,
CHEMBL325226,
N-[4-METHYL-9-(1-METHYLETHYL)-9H-CARBAZOL-3-YL]-4-MORPHOLINECARBOXAMIDE,
SCHEMBL6826732,
CTK8F0016,
DTXSID30432395,
HMS3678E15,
BDBM50116592,
ZINC27101553,
AKOS024457744,
NCGC00370914-01,
RT-014756,
B7466,
N-(4-Methyl-9-isopropyl-9H-carbazole-3-yl)morpholine-4-carboxamide,
Morpholine-4-carboxylic acid (9-isopropyl-4-methyl-9H-carbazol-3-yl)-amide,
D0I5HE,
NPY5RA-972,
CID9884833,
N-(4-methyl-9-propan-2-yl-carbazol-3-yl)morpholine-4-carboxamide,
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| Complexity | 506 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 351.195g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 26 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 351.45g/mol |
| Monoisotopic Mass | 351.195g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 46.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.2 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number