[1-[2-(6-butyl-9,10-dioxoanthracene-2-carbonyl)oxynaphthalen-1-yl]naphthalen-2-yl] 6-butyl-9,10-dioxoanthracene-2-carboxylate;[6-[3,5-dimethyl-4-(2-methylbutoxy)phenyl]-1-[6-[3,5-dimethyl-4-(2-methylbutoxy)phenyl]-2-(9,10-dioxoanthracene-2-carbonyl)oxynaphthalen-1-yl]naphthalen-2-yl] 9,10-dioxoanthracene-2-carboxylate;[2-[4-[(9,10-dioxoanthracene-2-carbonyl)amino]phenoxy]-1-phenylethyl] 4-(4-butylcyclohexyl)benzoate;[1-[2-(9,10-dioxoanthracene-2-carbonyl)oxynaphthalen-1-yl]naphthalen-2-yl] 9,10-dioxoanthracene-2-carboxylate

C230H173NO32 — CID 157088620

IUPAC[1-[2-(6-butyl-9,10-dioxoanthracene-2-carbonyl)oxynaphthalen-1-yl]naphthalen-2-yl] 6-butyl-9,10-dioxoanthracene-2-carboxylate;[6-[3,5-dimethyl-4-(2-methylbutoxy)phenyl]-1-[6-[3,5-dimethyl-4-(2-methylbutoxy)phenyl]-2-(9,10-dioxoanthracene-2-carbonyl)oxynaphthalen-1-yl]naphthalen-2-yl] 9,10-dioxoanthracene-2-carboxylate;[2-[4-[(9,10-dioxoanthracene-2-carbonyl)amino]phenoxy]-1-phenylethyl] 4-(4-butylcyclohexyl)benzoate;[1-[2-(9,10-dioxoanthracene-2-carbonyl)oxynaphthalen-1-yl]naphthalen-2-yl] 9,10-dioxoanthracene-2-carboxylate
SMILESCCC(C)COc1c(C)cc(-c2ccc3c(-c4c(OC(=O)c5ccc6c(c5)C(=O)c5ccccc5C6=O)ccc5cc(-c6cc(C)c(OCC(C)CC)c(C)c6)ccc45)c(OC(=O)c4ccc5c(c4)C(=O)c4ccccc4C5=O)ccc3c2)cc1C.CCCCC1CCC(c2ccc(C(=O)OC(COc3ccc(NC(=O)c4ccc5c(c4)C(=O)c4ccccc4C5=O)cc3)c3ccccc3)cc2)CC1.CCCCc1ccc2c(c1)C(=O)c1ccc(C(=O)Oc3ccc4ccccc4c3-c3c(OC(=O)c4ccc5c(c4)C(=O)c4ccc(CCCC)cc4C5=O)ccc4ccccc34)cc1C2=O.O=C(Oc1ccc2ccccc2c1-c1c(OC(=O)c2ccc3c(c2)C(=O)c2ccccc2C3=O)ccc2ccccc12)c1ccc2c(c1)C(=O)c1ccccc1C2=O
InChIInChI=1S/C76H62O10.C58H42O8.C50H26O8.C46H43NO6/c1-9-41(3)39-83-73-43(5)31-53(32-44(73)6)47-19-25-55-49(35-47)23-29-65(85-75(81)51-21-27-61-63(37-51)71(79)59-17-13-11-15-57(59)69(61)77)67(55)68-56-26-20-48(54-33-45(7)74(46(8)34-54)84-40-42(4)10-2)36-50(56)24-30-66(68)86-76(82)52-22-28-62-64(38-52)72(80)60-18-14-12-16-58(60)70(62)78;1-3-5-11-33-17-23-41-45(29-33)53(59)43-25-19-37(31-47(43)55(41)61)57(63)65-49-27-21-35-13-7-9-15-39(35)51(49)52-40-16-10-8-14-36(40)22-28-50(52)66-58(64)38-20-26-44-48(32-38)56(62)42-24-18-34(12-6-4-2)30-46(42)54(44)60;51-45-33-13-5-7-15-35(33)47(53)39-25-29(17-21-37(39)45)49(55)57-41-23-19-27-9-1-3-11-31(27)43(41)44-32-12-4-2-10-28(32)20-24-42(44)58-50(56)30-18-22-38-40(26-30)48(54)36-16-8-6-14-34(36)46(38)52;1-2-3-9-30-14-16-31(17-15-30)32-18-20-34(21-19-32)46(51)53-42(33-10-5-4-6-11-33)29-52-37-25-23-36(24-26-37)47-45(50)35-22-27-40-41(28-35)44(49)39-13-8-7-12-38(39)43(40)48/h11-38,41-42H,9-10,39-40H2,1-8H3;7-10,13-32H,3-6,11-12H2,1-2H3;1-26H;4-8,10-13,18-28,30-31,42H,2-3,9,14-17,29H2,1H3,(H,47,50)
InChIKeyAEJUKOUHIUCBSA-UHFFFAOYSA-N
MW3462.89 g/mol
LogP49.21
Rot. Bonds43

About [1-[2-(6-butyl-9,10-dioxoanthracene-2-carbonyl)oxynaphthalen-1-yl]naphthalen-2-yl] 6-butyl-9,10-dioxoanthracene-2-carboxylate;[6-[3,5-dimethyl-4-(2-methylbutoxy)phenyl]-1-[6-[3,5-dimethyl-4-(2-methylbutoxy)phenyl]-2-(9,10-dioxoanthracene-2-carbonyl)oxynaphthalen-1-yl]naphthalen-2-yl] 9,10-dioxoanthracene-2-carboxylate;[2-[4-[(9,10-dioxoanthracene-2-carbonyl)amino]phenoxy]-1-phenylethyl] 4-(4-butylcyclohexyl)benzoate;[1-[2-(9,10-dioxoanthracene-2-carbonyl)oxynaphthalen-1-yl]naphthalen-2-yl] 9,10-dioxoanthracene-2-carboxylate

[1-[2-(6-butyl-9,10-dioxoanthracene-2-carbonyl)oxynaphthalen-1-yl]naphthalen-2-yl] 6-butyl-9,10-dioxoanthracene-2-carboxylate;[6-[3,5-dimethyl-4-(2-methylbutoxy)phenyl]-1-[6-[3,5-dimethyl-4-(2-methylbutoxy)phenyl]-2-(9,10-dioxoanthracene-2-carbonyl)oxynaphthalen-1-yl]naphthalen-2-yl] 9,10-dioxoanthracene-2-carboxylate;[2-[4-[(9,10-dioxoanthracene-2-carbonyl)amino]phenoxy]-1-phenylethyl] 4-(4-butylcyclohexyl)benzoate;[1-[2-(9,10-dioxoanthracene-2-carbonyl)oxynaphthalen-1-yl]naphthalen-2-yl] 9,10-dioxoanthracene-2-carboxylate (PubChem CID 157088620) has the molecular formula C230H173NO32 and a molecular weight of 3462.89 g/mol. Its IUPAC name is [1-[2-(6-butyl-9,10-dioxoanthracene-2-carbonyl)oxynaphthalen-1-yl]naphthalen-2-yl] 6-butyl-9,10-dioxoanthracene-2-carboxylate;[6-[3,5-dimethyl-4-(2-methylbutoxy)phenyl]-1-[6-[3,5-dimethyl-4-(2-methylbutoxy)phenyl]-2-(9,10-dioxoanthracene-2-carbonyl)oxynaphthalen-1-yl]naphthalen-2-yl] 9,10-dioxoanthracene-2-carboxylate;[2-[4-[(9,10-dioxoanthracene-2-carbonyl)amino]phenoxy]-1-phenylethyl] 4-(4-butylcyclohexyl)benzoate;[1-[2-(9,10-dioxoanthracene-2-carbonyl)oxynaphthalen-1-yl]naphthalen-2-yl] 9,10-dioxoanthracene-2-carboxylate.

Molecular Properties

Compound Name[1-[2-(6-butyl-9,10-dioxoanthracene-2-carbonyl)oxynaphthalen-1-yl]naphthalen-2-yl] 6-butyl-9,10-dioxoanthracene-2-carboxylate;[6-[3,5-dimethyl-4-(2-methylbutoxy)phenyl]-1-[6-[3,5-dimethyl-4-(2-methylbutoxy)phenyl]-2-(9,10-dioxoanthracene-2-carbonyl)oxynaphthalen-1-yl]naphthalen-2-yl] 9,10-dioxoanthracene-2-carboxylate;[2-[4-[(9,10-dioxoanthracene-2-carbonyl)amino]phenoxy]-1-phenylethyl] 4-(4-butylcyclohexyl)benzoate;[1-[2-(9,10-dioxoanthracene-2-carbonyl)oxynaphthalen-1-yl]naphthalen-2-yl] 9,10-dioxoanthracene-2-carboxylate
PubChem CID157088620
Molecular FormulaC230H173NO32
Molecular Weight3462.89 g/mol
Exact Mass3460.19
IUPAC Name[1-[2-(6-butyl-9,10-dioxoanthracene-2-carbonyl)oxynaphthalen-1-yl]naphthalen-2-yl] 6-butyl-9,10-dioxoanthracene-2-carboxylate;[6-[3,5-dimethyl-4-(2-methylbutoxy)phenyl]-1-[6-[3,5-dimethyl-4-(2-methylbutoxy)phenyl]-2-(9,10-dioxoanthracene-2-carbonyl)oxynaphthalen-1-yl]naphthalen-2-yl] 9,10-dioxoanthracene-2-carboxylate;[2-[4-[(9,10-dioxoanthracene-2-carbonyl)amino]phenoxy]-1-phenylethyl] 4-(4-butylcyclohexyl)benzoate;[1-[2-(9,10-dioxoanthracene-2-carbonyl)oxynaphthalen-1-yl]naphthalen-2-yl] 9,10-dioxoanthracene-2-carboxylate
SMILESCCC(C)COc1c(C)cc(-c2ccc3c(-c4c(OC(=O)c5ccc6c(c5)C(=O)c5ccccc5C6=O)ccc5cc(-c6cc(C)c(OCC(C)CC)c(C)c6)ccc45)c(OC(=O)c4ccc5c(c4)C(=O)c4ccccc4C5=O)ccc3c2)cc1C.CCCCC1CCC(c2ccc(C(=O)OC(COc3ccc(NC(=O)c4ccc5c(c4)C(=O)c4ccccc4C5=O)cc3)c3ccccc3)cc2)CC1.CCCCc1ccc2c(c1)C(=O)c1ccc(C(=O)Oc3ccc4ccccc4c3-c3c(OC(=O)c4ccc5c(c4)C(=O)c4ccc(CCCC)cc4C5=O)ccc4ccccc34)cc1C2=O.O=C(Oc1ccc2ccccc2c1-c1c(OC(=O)c2ccc3c(c2)C(=O)c2ccccc2C3=O)ccc2ccccc12)c1ccc2c(c1)C(=O)c1ccccc1C2=O
InChIInChI=1S/C76H62O10.C58H42O8.C50H26O8.C46H43NO6/c1-9-41(3)39-83-73-43(5)31-53(32-44(73)6)47-19-25-55-49(35-47)23-29-65(85-75(81)51-21-27-61-63(37-51)71(79)59-17-13-11-15-57(59)69(61)77)67(55)68-56-26-20-48(54-33-45(7)74(46(8)34-54)84-40-42(4)10-2)36-50(56)24-30-66(68)86-76(82)52-22-28-62-64(38-52)72(80)60-18-14-12-16-58(60)70(62)78;1-3-5-11-33-17-23-41-45(29-33)53(59)43-25-19-37(31-47(43)55(41)61)57(63)65-49-27-21-35-13-7-9-15-39(35)51(49)52-40-16-10-8-14-36(40)22-28-50(52)66-58(64)38-20-26-44-48(32-38)56(62)42-24-18-34(12-6-4-2)30-46(42)54(44)60;51-45-33-13-5-7-15-35(33)47(53)39-25-29(17-21-37(39)45)49(55)57-41-23-19-27-9-1-3-11-31(27)43(41)44-32-12-4-2-10-28(32)20-24-42(44)58-50(56)30-18-22-38-40(26-30)48(54)36-16-8-6-14-34(36)46(38)52;1-2-3-9-30-14-16-31(17-15-30)32-18-20-34(21-19-32)46(51)53-42(33-10-5-4-6-11-33)29-52-37-25-23-36(24-26-37)47-45(50)35-22-27-40-41(28-35)44(49)39-13-8-7-12-38(39)43(40)48/h11-38,41-42H,9-10,39-40H2,1-8H3;7-10,13-32H,3-6,11-12H2,1-2H3;1-26H;4-8,10-13,18-28,30-31,42H,2-3,9,14-17,29H2,1H3,(H,47,50)
InChIKeyAEJUKOUHIUCBSA-UHFFFAOYSA-N
XLogP49.21
TPSA479.87 Ų
H-Bond Donors1
H-Bond Acceptors32
Rotatable Bonds43
Heavy Atoms263
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003462.89
LogP ≤ 549.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1032

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'quinone_A(370)', 'substructure': 'N/A'}, {'alert_name': 'phenol_ester', 'substructure': 'N/A'}

Analyze [1-[2-(6-butyl-9,10-dioxoanthracene-2-carbonyl)oxynaphthalen-1-yl]naphthalen-2-yl] 6-butyl-9,10-dioxoanthracene-2-carboxylate;[6-[3,5-dimethyl-4-(2-methylbutoxy)phenyl]-1-[6-[3,5-dimethyl-4-(2-methylbutoxy)phenyl]-2-(9,10-dioxoanthracene-2-carbonyl)oxynaphthalen-1-yl]naphthalen-2-yl] 9,10-dioxoanthracene-2-carboxylate;[2-[4-[(9,10-dioxoanthracene-2-carbonyl)amino]phenoxy]-1-phenylethyl] 4-(4-butylcyclohexyl)benzoate;[1-[2-(9,10-dioxoanthracene-2-carbonyl)oxynaphthalen-1-yl]naphthalen-2-yl] 9,10-dioxoanthracene-2-carboxylate with MolForge

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Related Compounds

[1-[2-[4-[4-(4-butylcyclohexyl)phenyl]benzoyl]oxynaphthalen-1-yl]-5,6-dihydronaphthalen-2-yl] 4-[4-(4-butylcyclohexyl)phenyl]benzoate
CID 139504091
bis(iron(2+));[2-[4-(4-isocyanophenyl)benzoyl]oxy-2-phenylethyl] 9,10-dioxoanthracene-2-carboxylate;methylcyclopentane;bis([2-(2-methylcyclopentanecarbonyl)oxy-1-phenylethyl] 4-(4-pentylcyclohexyl)benzoate);[4-[2-[4-(4-pentylcyclohexyl)benzoyl]oxy-2-phenylethoxy]carbonylphenyl] 9,10-dioxoanthracene-2-carboxylate;[4-[2-[4-(4-pentylcyclohexyl)cyclohexanecarbonyl]oxy-2-phenylethoxy]carbonylphenyl] 9,10-dioxoanthracene-2-carboxylate;[4-(4-pentylcyclohexyl)phenyl] 2-methylcyclopentane-1-carboxylate
CID 158686951
[6-[4-(4-propylcyclohexyl)phenyl]-1-[6-[4-(4-propylcyclohexyl)phenyl]-2-[12-(6-propylnaphthalen-2-yl)oxydodecanoyloxy]naphthalen-1-yl]naphthalen-2-yl] 12-(6-propylnaphthalen-2-yl)oxydodecanoate
CID 152978860
4-(4-butylcyclohexyl)-N-[4-(4-methylphenyl)phenyl]benzamide
CID 138461387
[(2S)-2-[4-(4-pentylcyclohexyl)benzoyl]oxy-2-phenylethyl] 4-(4-methylcyclohexyl)benzoate
CID 157493250
1-(2-methylbutoxy)-4-[4-(4-octylcyclohexyl)phenyl]benzene
CID 20539250
1-(4-decylcyclohexyl)-4-[4-(2-methylbutoxy)phenyl]benzene
CID 20539348
[4-[[5-(4-butylanilino)-3,7-bis[4-(4-butylcyclohexyl)phenoxy]-4,8-dihydroxy-9,10-dioxoanthracen-1-yl]amino]phenyl] 4-butylbenzoate
CID 176786543
[4-(4-octylcyclohexyl)phenyl] 4-butylbenzoate
CID 23334690
[4-[4-(2-methylbutyl)cyclohexyl]phenyl] 4-pentylbenzoate
CID 23334871
(4-hexylphenyl) 4-octan-2-yloxybenzoate;4-[4-(2-methylbutoxy)phenyl]benzonitrile;4-[4-(2-methylbutyl)phenyl]benzonitrile;1-(2-methylbut-3-ynyl)-4-[4-(4-methylcyclohexyl)cyclohexyl]benzene;molecular hydrogen;(4-octan-2-yloxycarbonylphenyl) 4-methylbenzoate;[2-[[4-(4-pentylcyclohexyl)phenyl]methylperoxy]-1-phenylethyl] 4-(4-methylcyclohexyl)benzoate;1-phenylpropyl 4-(4-methylphenyl)benzoate;1-phenylpropyl 4-(4-pentylphenyl)benzoate
CID 158581638
[2-[[4-(4-pentylcyclohexyl)phenoxy]methoxy]-2-phenylethyl] 4-(4-pentylcyclohexyl)benzoate
CID 59863396

Frequently Asked Questions

What is the IUPAC name of [1-[2-(6-butyl-9,10-dioxoanthracene-2-carbonyl)oxynaphthalen-1-yl]naphthalen-2-yl] 6-butyl-9,10-dioxoanthracene-2-carboxylate;[6-[3,5-dimethyl-4-(2-methylbutoxy)phenyl]-1-[6-[3,5-dimethyl-4-(2-methylbutoxy)phenyl]-2-(9,10-dioxoanthracene-2-carbonyl)oxynaphthalen-1-yl]naphthalen-2-yl] 9,10-dioxoanthracene-2-carboxylate;[2-[4-[(9,10-dioxoanthracene-2-carbonyl)amino]phenoxy]-1-phenylethyl] 4-(4-butylcyclohexyl)benzoate;[1-[2-(9,10-dioxoanthracene-2-carbonyl)oxynaphthalen-1-yl]naphthalen-2-yl] 9,10-dioxoanthracene-2-carboxylate?
The IUPAC name of [1-[2-(6-butyl-9,10-dioxoanthracene-2-carbonyl)oxynaphthalen-1-yl]naphthalen-2-yl] 6-butyl-9,10-dioxoanthracene-2-carboxylate;[6-[3,5-dimethyl-4-(2-methylbutoxy)phenyl]-1-[6-[3,5-dimethyl-4-(2-methylbutoxy)phenyl]-2-(9,10-dioxoanthracene-2-carbonyl)oxynaphthalen-1-yl]naphthalen-2-yl] 9,10-dioxoanthracene-2-carboxylate;[2-[4-[(9,10-dioxoanthracene-2-carbonyl)amino]phenoxy]-1-phenylethyl] 4-(4-butylcyclohexyl)benzoate;[1-[2-(9,10-dioxoanthracene-2-carbonyl)oxynaphthalen-1-yl]naphthalen-2-yl] 9,10-dioxoanthracene-2-carboxylate (CID 157088620) is [1-[2-(6-butyl-9,10-dioxoanthracene-2-carbonyl)oxynaphthalen-1-yl]naphthalen-2-yl] 6-butyl-9,10-dioxoanthracene-2-carboxylate;[6-[3,5-dimethyl-4-(2-methylbutoxy)phenyl]-1-[6-[3,5-dimethyl-4-(2-methylbutoxy)phenyl]-2-(9,10-dioxoanthracene-2-carbonyl)oxynaphthalen-1-yl]naphthalen-2-yl] 9,10-dioxoanthracene-2-carboxylate;[2-[4-[(9,10-dioxoanthracene-2-carbonyl)amino]phenoxy]-1-phenylethyl] 4-(4-butylcyclohexyl)benzoate;[1-[2-(9,10-dioxoanthracene-2-carbonyl)oxynaphthalen-1-yl]naphthalen-2-yl] 9,10-dioxoanthracene-2-carboxylate.
What is the SMILES notation for [1-[2-(6-butyl-9,10-dioxoanthracene-2-carbonyl)oxynaphthalen-1-yl]naphthalen-2-yl] 6-butyl-9,10-dioxoanthracene-2-carboxylate;[6-[3,5-dimethyl-4-(2-methylbutoxy)phenyl]-1-[6-[3,5-dimethyl-4-(2-methylbutoxy)phenyl]-2-(9,10-dioxoanthracene-2-carbonyl)oxynaphthalen-1-yl]naphthalen-2-yl] 9,10-dioxoanthracene-2-carboxylate;[2-[4-[(9,10-dioxoanthracene-2-carbonyl)amino]phenoxy]-1-phenylethyl] 4-(4-butylcyclohexyl)benzoate;[1-[2-(9,10-dioxoanthracene-2-carbonyl)oxynaphthalen-1-yl]naphthalen-2-yl] 9,10-dioxoanthracene-2-carboxylate?
The canonical SMILES for [1-[2-(6-butyl-9,10-dioxoanthracene-2-carbonyl)oxynaphthalen-1-yl]naphthalen-2-yl] 6-butyl-9,10-dioxoanthracene-2-carboxylate;[6-[3,5-dimethyl-4-(2-methylbutoxy)phenyl]-1-[6-[3,5-dimethyl-4-(2-methylbutoxy)phenyl]-2-(9,10-dioxoanthracene-2-carbonyl)oxynaphthalen-1-yl]naphthalen-2-yl] 9,10-dioxoanthracene-2-carboxylate;[2-[4-[(9,10-dioxoanthracene-2-carbonyl)amino]phenoxy]-1-phenylethyl] 4-(4-butylcyclohexyl)benzoate;[1-[2-(9,10-dioxoanthracene-2-carbonyl)oxynaphthalen-1-yl]naphthalen-2-yl] 9,10-dioxoanthracene-2-carboxylate is CCC(C)COc1c(C)cc(-c2ccc3c(-c4c(OC(=O)c5ccc6c(c5)C(=O)c5ccccc5C6=O)ccc5cc(-c6cc(C)c(OCC(C)CC)c(C)c6)ccc45)c(OC(=O)c4ccc5c(c4)C(=O)c4ccccc4C5=O)ccc3c2)cc1C.CCCCC1CCC(c2ccc(C(=O)OC(COc3ccc(NC(=O)c4ccc5c(c4)C(=O)c4ccccc4C5=O)cc3)c3ccccc3)cc2)CC1.CCCCc1ccc2c(c1)C(=O)c1ccc(C(=O)Oc3ccc4ccccc4c3-c3c(OC(=O)c4ccc5c(c4)C(=O)c4ccc(CCCC)cc4C5=O)ccc4ccccc34)cc1C2=O.O=C(Oc1ccc2ccccc2c1-c1c(OC(=O)c2ccc3c(c2)C(=O)c2ccccc2C3=O)ccc2ccccc12)c1ccc2c(c1)C(=O)c1ccccc1C2=O.
What is the InChIKey of [1-[2-(6-butyl-9,10-dioxoanthracene-2-carbonyl)oxynaphthalen-1-yl]naphthalen-2-yl] 6-butyl-9,10-dioxoanthracene-2-carboxylate;[6-[3,5-dimethyl-4-(2-methylbutoxy)phenyl]-1-[6-[3,5-dimethyl-4-(2-methylbutoxy)phenyl]-2-(9,10-dioxoanthracene-2-carbonyl)oxynaphthalen-1-yl]naphthalen-2-yl] 9,10-dioxoanthracene-2-carboxylate;[2-[4-[(9,10-dioxoanthracene-2-carbonyl)amino]phenoxy]-1-phenylethyl] 4-(4-butylcyclohexyl)benzoate;[1-[2-(9,10-dioxoanthracene-2-carbonyl)oxynaphthalen-1-yl]naphthalen-2-yl] 9,10-dioxoanthracene-2-carboxylate?
The InChIKey is AEJUKOUHIUCBSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C76H62O10.C58H42O8.C50H26O8.C46H43NO6/c1-9-41(3)39-83-73-43(5)31-53(32-44(73)6)47-19-25-55-49(35-47)23-29-65(85-75(81)51-21-27-61-63(37-51)71(79)59-17-13-11-15-57(59)69(61)77)67(55)68-56-26-20-48(54-33-45(7)74(46(8)34-54)84-40-42(4)10-2)36-50(56)24-30-66(68)86-76(82)52-22-28-62-64(38-52)72(80)60-18-14-12-16-58(60)70(62)78;1-3-5-11-33-17-23-41-45(29-33)53(59)43-25-19-37(31-47(43)55(41)61)57(63)65-49-27-21-35-13-7-9-15-39(35)51(49)52-40-16-10-8-14-36(40)22-28-50(52)66-58(64)38-20-26-44-48(32-38)56(62)42-24-18-34(12-6-4-2)30-46(42)54(44)60;51-45-33-13-5-7-15-35(33)47(53)39-25-29(17-21-37(39)45)49(55)57-41-23-19-27-9-1-3-11-31(27)43(41)44-32-12-4-2-10-28(32)20-24-42(44)58-50(56)30-18-22-38-40(26-30)48(54)36-16-8-6-14-34(36)46(38)52;1-2-3-9-30-14-16-31(17-15-30)32-18-20-34(21-19-32)46(51)53-42(33-10-5-4-6-11-33)29-52-37-25-23-36(24-26-37)47-45(50)35-22-27-40-41(28-35)44(49)39-13-8-7-12-38(39)43(40)48/h11-38,41-42H,9-10,39-40H2,1-8H3;7-10,13-32H,3-6,11-12H2,1-2H3;1-26H;4-8,10-13,18-28,30-31,42H,2-3,9,14-17,29H2,1H3,(H,47,50).
What are the key properties of [1-[2-(6-butyl-9,10-dioxoanthracene-2-carbonyl)oxynaphthalen-1-yl]naphthalen-2-yl] 6-butyl-9,10-dioxoanthracene-2-carboxylate;[6-[3,5-dimethyl-4-(2-methylbutoxy)phenyl]-1-[6-[3,5-dimethyl-4-(2-methylbutoxy)phenyl]-2-(9,10-dioxoanthracene-2-carbonyl)oxynaphthalen-1-yl]naphthalen-2-yl] 9,10-dioxoanthracene-2-carboxylate;[2-[4-[(9,10-dioxoanthracene-2-carbonyl)amino]phenoxy]-1-phenylethyl] 4-(4-butylcyclohexyl)benzoate;[1-[2-(9,10-dioxoanthracene-2-carbonyl)oxynaphthalen-1-yl]naphthalen-2-yl] 9,10-dioxoanthracene-2-carboxylate?
[1-[2-(6-butyl-9,10-dioxoanthracene-2-carbonyl)oxynaphthalen-1-yl]naphthalen-2-yl] 6-butyl-9,10-dioxoanthracene-2-carboxylate;[6-[3,5-dimethyl-4-(2-methylbutoxy)phenyl]-1-[6-[3,5-dimethyl-4-(2-methylbutoxy)phenyl]-2-(9,10-dioxoanthracene-2-carbonyl)oxynaphthalen-1-yl]naphthalen-2-yl] 9,10-dioxoanthracene-2-carboxylate;[2-[4-[(9,10-dioxoanthracene-2-carbonyl)amino]phenoxy]-1-phenylethyl] 4-(4-butylcyclohexyl)benzoate;[1-[2-(9,10-dioxoanthracene-2-carbonyl)oxynaphthalen-1-yl]naphthalen-2-yl] 9,10-dioxoanthracene-2-carboxylate has a molecular weight of 3462.89 g/mol, XLogP of 49.21, 43 rotatable bonds, 1 hydrogen bond donors, and 32 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[2-(6-butyl-9,10-dioxoanthracene-2-carbonyl)oxynaphthalen-1-yl]naphthalen-2-yl] 6-butyl-9,10-dioxoanthracene-2-carboxylate;[6-[3,5-dimethyl-4-(2-methylbutoxy)phenyl]-1-[6-[3,5-dimethyl-4-(2-methylbutoxy)phenyl]-2-(9,10-dioxoanthracene-2-carbonyl)oxynaphthalen-1-yl]naphthalen-2-yl] 9,10-dioxoanthracene-2-carboxylate;[2-[4-[(9,10-dioxoanthracene-2-carbonyl)amino]phenoxy]-1-phenylethyl] 4-(4-butylcyclohexyl)benzoate;[1-[2-(9,10-dioxoanthracene-2-carbonyl)oxynaphthalen-1-yl]naphthalen-2-yl] 9,10-dioxoanthracene-2-carboxylate is sourced from PubChem (CID 157088620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).