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ethyl 6-methyl-2-[2-(morpholin-4-yl)acetamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

ethyl 6-methyl-2-[2-(morpholin-4-yl)acetamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Formula: C18H26N2O4S

SMILES: CCOC(=O)C1=C(NC(=O)CN2CCOCC2)SC2=C1CCC(C)C2

IUPAC: ethyl 6-methyl-2-[2-(morpholin-4-yl)acetamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

InChI: InChI=1/C18H26N2O4S/c1-3-24-18(22)16-13-5-4-12(2)10-14(13)25-17(16)19-15(21)11-20-6-8-23-9-7-20/h12H,3-11H2,1-2H3,(H,19,21)

Composition: C (58.99%), H (7.15%), N (7.64%), O (17.46%), S (8.75%)

Molar Mass: 366.48

Atom Count: 51

Heavy Atom Count: 25

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 1
Exact Mass 366.161328499
Formal Charge 0
FSP3 0.67
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 1
InChIKey OIUCVSKUIBLACK-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 98.43
Topological Polar Surface Area 67.87
Polarizability 37.38
Ring Count 3
Rotatable Bond Count 6

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C18H26N2O4S $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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