| CAS Number | 1493762-74-5 |
| Catalog Number | AG01EOS1(AGN-PC-3H46I9) |
| Chemical Name | BM635 |
| IUPAC Name | 4-[[1-(4-fluorophenyl)-2-methyl-5-(4-propan-2-ylphenyl)pyrrol-3-yl]methyl]morpholine |
| InChI | InChI=1S/C25H29FN2O/c1-18(2)20-4-6-21(7-5-20)25-16-22(17-27-12-14-29-15-13-27)19(3)28(25)24-10-8-23(26)9-11-24/h4-11,16,18H,12-15,17H2,1-3H3 |
| InChI Key | NEEGNYKRJDHJNX-UHFFFAOYSA-N |
| MDL Number | MFCD31619277 |
| Molecular Formula | C25H29FN2O |
| Molecular Weight | 392.5090 |
| SMILES | N1(CC2C=C(C3=CC=C(C(C)C)C=C3)N(C3=CC=C(F)C=C3)C=2C)CCOCC1 |
| Synonyms | BM635,
CHEMBL4069395,
HY-109587,
CS-0032638,
4-[[1-(4-fluorophenyl)-5-(4-isopropylphenyl)-2-methyl-pyrrol-3-yl]methyl]morpholine,
1493762-74-5,
|
| Complexity | 493 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 392.226g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 29 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 392.518g/mol |
| Monoisotopic Mass | 392.226g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 17.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 5.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number