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2-[(2-chlorophenyl)(1,1-dioxo-1??,2-benzothiazol-3-yl)amino]ethyl 2-methoxybenzoate

2-[(2-chlorophenyl)(1,1-dioxo-1??,2-benzothiazol-3-yl)amino]ethyl 2-methoxybenzoate

Formula: C23H19ClN2O5S

SMILES: COC1=CC=CC=C1C(=O)OCCN(C1=NS(=O)(=O)C2=C1C=CC=C2)C1=CC=CC=C1Cl

IUPAC: 2-[(2-chlorophenyl)(1,1-dioxo-1??,2-benzothiazol-3-yl)amino]ethyl 2-methoxybenzoate

InChI: InChI=1S/C23H19ClN2O5S/c1-30-20-12-6-2-8-16(20)23(27)31-15-14-26(19-11-5-4-10-18(19)24)22-17-9-3-7-13-21(17)32(28,29)25-22/h2-13H,14-15H2,1H3

Composition: C (58.66%), H (4.07%), Cl (7.53%), N (5.95%), O (16.99%), S (6.81%)

Molar Mass: 470.92

Atom Count: 51

Heavy Atom Count: 32

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 470.0703206
Formal Charge 0
FSP3 0.13
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 6
Hydrogen Bond Donor Count 0
InChIKey YHZDBOMPUHVNNV-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 122.32
Topological Polar Surface Area 85.27
Polarizability 47.31
Ring Count 4
Rotatable Bond Count 7

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C23H19ClN2O5S $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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