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15,16-dimethoxy-10-azatetracyclo[7.7.1.0²,?.0¹³,¹?]heptadeca-1(17),2(7),3,5,8,13,15-heptaene-11,12-dione

15,16-dimethoxy-10-azatetracyclo[7.7.1.0²,?.0¹³,¹?]heptadeca-1(17),2(7),3,5,8,13,15-heptaene-11,12-dione

CAS: 57576-41-7

Formula: C18H13NO4

SMILES: COC1=C(OC)C2=C3C(NC(=O)C(=O)C3=C1)=CC1=C2C=CC=C1

IUPAC: 15,16-dimethoxy-10-azatetracyclo[7.7.1.0²,?.0¹³,¹?]heptadeca-1(17),2(7),3,5,8,13,15-heptaene-11,12-dione

InChI: InChI=1S/C18H13NO4/c1-22-13-8-11-14-12(19-18(21)16(11)20)7-9-5-3-4-6-10(9)15(14)17(13)23-2/h3-8H,1-2H3,(H,19,21)

Composition: C (70.35%), H (4.26%), N (4.56%), O (20.82%)

Molar Mass: 307.305

Atom Count: 36

Heavy Atom Count: 23

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 307.084457903
Formal Charge 0
FSP3 0.11
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 1
InChIKey BAGGDUOPTSQTHD-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 86.3
Topological Polar Surface Area 64.63
Polarizability 34.59
Ring Count 4
Rotatable Bond Count 2

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Wuhan ChemFaces Biochemical Co., Ltd
Purity LeadTime CAS PacketSize UnitPrice
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AA BLOCKS INC
Purity LeadTime CAS PacketSize UnitPrice
98% <6 Days 57576-41-7 $1,017.75-$5,957.00$1,017.75$1,687.05$3,515.55$5,957.00$10,272.95
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