| CAS Number | 862896-30-8 |
| Catalog Number | AG01EOKO(AGN-PC-3H46F1) |
| Chemical Name | S 38093 |
| IUPAC Name | 4-[3-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)propoxy]benzamide |
| InChI | InChI=1S/C17H24N2O2/c18-17(20)13-5-7-16(8-6-13)21-10-2-9-19-11-14-3-1-4-15(14)12-19/h5-8,14-15H,1-4,9-12H2,(H2,18,20) |
| InChI Key | MRNMYWNBLVJWKG-UHFFFAOYSA-N |
| MDL Number | MFCD31560487 |
| Molecular Formula | C17H24N2O2 |
| Molecular Weight | 288.3847 |
| SMILES | C1N(CC2C1CCC2)CCCOC2=CC=C(C(=O)N)C=C2 |
| Synonyms | S 38093,
S 38093,
862896-30-8,
s38093,
S-38093 free base,
SCHEMBL3348406,
BCP29144,
s8598,
CS-7716,
HY-104003,
S-38093,
s38093 free,
CID11380684,
4-[3-(3-azabicyclo[3.3.0]oct-3-yl)propoxy]benzamide,
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| Complexity | 341 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 288.184g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 21 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 288.391g/mol |
| Monoisotopic Mass | 288.184g/mol |
| Rotatable Bond Count | 6 |
| Topological Polar Surface Area | 55.6A^2 |
| Undefined Atom Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.5 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number