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(5Z)-1-(3-chlorophenyl)-5-({[2-(1H-indol-3-yl)ethyl]amino}methylidene)-1,3-diazinane-2,4,6-trione

(5Z)-1-(3-chlorophenyl)-5-({[2-(1H-indol-3-yl)ethyl]amino}methylidene)-1,3-diazinane-2,4,6-trione

Formula: C21H17ClN4O3

SMILES: ClC1=CC=CC(=C1)N1C(=O)NC(=O)C(=CNCCC2=CNC3=CC=CC=C23)C1=O

IUPAC: (5Z)-1-(3-chlorophenyl)-5-({[2-(1H-indol-3-yl)ethyl]amino}methylidene)-1,3-diazinane-2,4,6-trione

InChI: InChI=1S/C21H17ClN4O3/c22-14-4-3-5-15(10-14)26-20(28)17(19(27)25-21(26)29)12-23-9-8-13-11-24-18-7-2-1-6-16(13)18/h1-7,10-12,23-24H,8-9H2,(H,25,27,29)/b17-12-

Composition: C (61.69%), H (4.19%), Cl (8.67%), N (13.70%), O (11.74%)

Molar Mass: 408.84

Atom Count: 46

Heavy Atom Count: 29

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 408.0989181
Formal Charge 0
FSP3 0.1
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 3
InChIKey CRUVVIFJNKEJLO-ATVHPVEESA-N
Lipinski's Rule of Five 1
Molar Refractivity 108.7
Topological Polar Surface Area 94.3
Polarizability 42.45
Ring Count 4
Rotatable Bond Count 5

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C21H17ClN4O3 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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