| CAS Number | 924376-11-4 |
| Catalog Number | AG019PCB |
| Chemical Name | 2-chloro-N-[4-methyl-3-(morpholine-4-carbonyl)-5-phenylthiophen-2-yl]acetamide |
| IUPAC Name | 2-chloro-N-[4-methyl-3-(morpholine-4-carbonyl)-5-phenylthiophen-2-yl]acetamide |
| InChI | InChI=1S/C18H19ClN2O3S/c1-12-15(18(23)21-7-9-24-10-8-21)17(20-14(22)11-19)25-16(12)13-5-3-2-4-6-13/h2-6H,7-11H2,1H3,(H,20,22) |
| InChI Key | ZZAHXZVBGVXCPI-UHFFFAOYSA-N |
| MDL Number | MFCD08444139 |
| Molecular Formula | C18H19ClN2O3S |
| Molecular Weight | 378.8731 |
| SMILES | CC1C(C(N2CCOCC2)=O)=C(NC(CCl)=O)SC=1C1=CC=CC=C1 |
| Synonyms | 2-chloro-N-[4-methyl-3-(morpholin-4-ylcarbonyl)-5-phenylthien-2-yl]acetamide,
2-chloro-N-[4-methyl-3-(morpholine-4-carbonyl)-5-phenylthiophen-2-yl]acetamide,
924376-11-4,
2-chloro-N-(4-methyl-3-(morpholine-4-carbonyl)-5-phenylthiophen-2-yl)acetamide,
AC1Q2GGV,
CTK6H5750,
ZINC8155941,
AKOS001276146,
MCULE-4755876939,
NE44290,
UPCMLD0ENAT5607883:001,
EN300-23190,
2-chloro-N-{4-methyl-3-[(morpholin-4-yl)carbonyl]-5-phenylthiophen-2-yl}acetamide,
ZINC08155941,
CID9291130,
|
| Complexity | 481 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 378.08g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 25 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 378.871g/mol |
| Monoisotopic Mass | 378.08g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 86.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number