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ethyl 2-(morpholin-4-yl)-5-[(thiophen-2-ylmethyl)amino]benzoate

ethyl 2-(morpholin-4-yl)-5-[(thiophen-2-ylmethyl)amino]benzoate

Formula: C18H22N2O3S

SMILES: CCOC(=O)C1=CC(NCC2=CC=CS2)=CC=C1N1CCOCC1

IUPAC: ethyl 2-(morpholin-4-yl)-5-{[(thiophen-2-yl)methyl]amino}benzoate

InChI: InChI=1S/C18H22N2O3S/c1-2-23-18(21)16-12-14(19-13-15-4-3-11-24-15)5-6-17(16)20-7-9-22-10-8-20/h3-6,11-12,19H,2,7-10,13H2,1H3

Composition: C (62.40%), H (6.40%), N (8.09%), O (13.85%), S (9.25%)

Molar Mass: 346.45

Atom Count: 46

Heavy Atom Count: 24

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 346.13511375
Formal Charge 0
FSP3 0.39
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 1
InChIKey ZKPGVCVMIYMSJO-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 98.03
Topological Polar Surface Area 50.8
Polarizability 36.3
Ring Count 3
Rotatable Bond Count 7

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C18H22N2O3S $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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