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(2E)-2-[4-(3,4-dichlorophenyl)-1,3-thiazol-2-yl]-3-(5-methylfuran-2-yl)prop-2-enenitrile

(2E)-2-[4-(3,4-dichlorophenyl)-1,3-thiazol-2-yl]-3-(5-methylfuran-2-yl)prop-2-enenitrile

Formula: C17H10Cl2N2OS

SMILES: CC1=CC=C(O1)C=C(/C#N)C1=NC(=CS1)C1=CC=C(Cl)C(Cl)=C1

IUPAC: (2E)-2-[4-(3,4-dichlorophenyl)-1,3-thiazol-2-yl]-3-(5-methylfuran-2-yl)prop-2-enenitrile

InChI: InChI=1S/C17H10Cl2N2OS/c1-10-2-4-13(22-10)6-12(8-20)17-21-16(9-23-17)11-3-5-14(18)15(19)7-11/h2-7,9H,1H3/b12-6+

Composition: C (56.52%), H (2.79%), Cl (19.63%), N (7.75%), O (4.43%), S (8.87%)

Molar Mass: 361.24

Atom Count: 33

Heavy Atom Count: 23

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 359.9890895
Formal Charge 0
FSP3 0.06
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 0
InChIKey VRQQTCSKMNXBAW-WUXMJOGZSA-N
Lipinski's Rule of Five
Molar Refractivity 93.09
Topological Polar Surface Area 49.82
Polarizability 36.18
Ring Count 3
Rotatable Bond Count 3

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C17H10Cl2N2OS $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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