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(3S)-4-[(2,4-dimethoxyphenyl)methyl]-3-methylpiperazin-2-one

(3S)-4-[(2,4-dimethoxyphenyl)methyl]-3-methylpiperazin-2-one

CAS: 1427063-32-8

Formula: C14H20N2O3

SMILES: COC1=CC=C(CN2CCNC(=O)[C@@H]2C)C(OC)=C1

IUPAC: (3S)-4-[(2,4-dimethoxyphenyl)methyl]-3-methylpiperazin-2-one

InChI: InChI=1S/C14H20N2O3/c1-10-14(17)15-6-7-16(10)9-11-4-5-12(18-2)8-13(11)19-3/h4-5,8,10H,6-7,9H2,1-3H3,(H,15,17)/t10-/m0/s1

Composition: C (63.62%), H (7.63%), N (10.60%), O (18.16%)

Molar Mass: 264.325

Atom Count: 39

Heavy Atom Count: 19

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 1
Exact Mass 264.147392512
Formal Charge 0
FSP3 0.5
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 1
InChIKey VRRFLEAHVFVBIE-JTQLQIEISA-N
Lipinski's Rule of Five 1
Molar Refractivity 72.86
Topological Polar Surface Area 50.8
Polarizability 28.42
Ring Count 2
Rotatable Bond Count 4

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Purity LeadTime CAS PacketSize UnitPrice
97% <7 Days 1427063-32-8 $254.32-$3,061.19$254.32$382.42$510.51$766.70$3,061.19
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Purity LeadTime CAS PacketSize UnitPrice
98% <2 Days 1427063-32-8 $227.70-$2,748.50$227.70$342.70$457.70$687.70$2,748.50$11,293.00
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