3-Cyclohexyl-N-(3,5-dichlorophenyl)-2-(1,1-dioxo-1lambda6-thiomorpholin-4-yl)propanamide - CAS 343373-27-3
Catalog: |
BB068817 |
Product Name: |
3-Cyclohexyl-N-(3,5-dichlorophenyl)-2-(1,1-dioxo-1lambda6-thiomorpholin-4-yl)propanamide |
CAS: |
343373-27-3 |
Synonyms: |
3-Cyclohexyl-N-(3,5-dichlorophenyl)-2-(1,1-dioxidothiomorpholino)propanamide |
IUPAC Name: | 3-cyclohexyl-N-(3,5-dichlorophenyl)-2-(1,1-dioxo-1,4-thiazinan-4-yl)propanamide |
Description: | 3-Cyclohexyl-N-(3,5-dichlorophenyl)-2-(1,1-dioxo-1lambda6-thiomorpholin-4-yl)propanamide is a useful research chemical. |
Molecular Weight: | 433.39 |
Molecular Formula: | C19H26Cl2N2O3S |
Canonical SMILES: | C1CCC(CC1)CC(C(=O)NC2=CC(=CC(=C2)Cl)Cl)N3CCS(=O)(=O)CC3 |
InChI: | InChI=1S/C19H26Cl2N2O3S/c20-15-11-16(21)13-17(12-15)22-19(24)18(10-14-4-2-1-3-5-14)23-6-8-27(25,26)9-7-23/h11-14,18H,1-10H2,(H,22,24) |
InChI Key: | VRICGDPYIYYSIG-UHFFFAOYSA-N |
Complexity: | 581 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 432.1041193 |
Formal Charge: | 0 |
Heavy Atom Count: | 27 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 432.1041193 |
Rotatable Bond Count: | 5 |
Topological Polar Surface Area: | 74.9Ų |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 4.7 |
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