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1-[4-methyl-2-(pyridin-3-yl)-1,3-thiazol-5-yl]ethyl N-(3-chlorophenyl)carbamate

1-[4-methyl-2-(pyridin-3-yl)-1,3-thiazol-5-yl]ethyl N-(3-chlorophenyl)carbamate

CAS: 866049-63-0

Formula: C18H16ClN3O2S

SMILES: CC(OC(=O)NC1=CC=CC(Cl)=C1)C1=C(C)N=C(S1)C1=CN=CC=C1

IUPAC: 1-[4-methyl-2-(pyridin-3-yl)-1,3-thiazol-5-yl]ethyl N-(3-chlorophenyl)carbamate

InChI: InChI=1/C18H16ClN3O2S/c1-11-16(25-17(21-11)13-5-4-8-20-10-13)12(2)24-18(23)22-15-7-3-6-14(19)9-15/h3-10,12H,1-2H3,(H,22,23)

Composition: C (57.83%), H (4.31%), Cl (9.48%), N (11.24%), O (8.56%), S (8.58%)

Molar Mass: 373.86

Atom Count: 41

Heavy Atom Count: 25

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 1
Exact Mass 373.0651756
Formal Charge 0
FSP3 0.17
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 1
InChIKey NDEXCRXOQDRQLN-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 108.91
Topological Polar Surface Area 64.11
Polarizability 38.13
Ring Count 3
Rotatable Bond Count 5

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Purity LeadTime CAS PacketSize UnitPrice
90% <2 Days 866049-63-0 $51.35-$86.31$51.35$63.37$86.31
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