[(Z)-(9-benzoyl-6-ethylfuro[3,2-c]carbazol-3-ylidene)amino] acetate;[(E)-(7-ethyl-2,3-dihydropyrano[3,2-c]carbazol-4-ylidene)amino] acetate;[(Z)-(6-ethylfuro[3,2-c]carbazol-3-ylidene)amino] acetate;[(E)-[7-ethyl-10-(2-methylbenzoyl)-2,3-dihydropyrano[3,2-c]carbazol-4-ylidene]amino] acetate;[(Z)-[6-ethyl-9-(2-methylbenzoyl)furo[3,2-c]carbazol-3-ylidene]amino] acetate;[(Z)-[6-ethyl-9-(4-morpholin-4-ylbenzoyl)furo[3,2-c]carbazol-3-ylidene]amino] acetate

C144H127N13O23 — CID 172937648

IUPAC[(Z)-(9-benzoyl-6-ethylfuro[3,2-c]carbazol-3-ylidene)amino] acetate;[(E)-(7-ethyl-2,3-dihydropyrano[3,2-c]carbazol-4-ylidene)amino] acetate;[(Z)-(6-ethylfuro[3,2-c]carbazol-3-ylidene)amino] acetate;[(E)-[7-ethyl-10-(2-methylbenzoyl)-2,3-dihydropyrano[3,2-c]carbazol-4-ylidene]amino] acetate;[(Z)-[6-ethyl-9-(2-methylbenzoyl)furo[3,2-c]carbazol-3-ylidene]amino] acetate;[(Z)-[6-ethyl-9-(4-morpholin-4-ylbenzoyl)furo[3,2-c]carbazol-3-ylidene]amino] acetate
SMILESCCn1c2ccc(C(=O)c3ccc(N4CCOCC4)cc3)cc2c2c3c(ccc21)/C(=N/OC(C)=O)CO3.CCn1c2ccc(C(=O)c3ccccc3)cc2c2c3c(ccc21)/C(=N/OC(C)=O)CO3.CCn1c2ccc(C(=O)c3ccccc3C)cc2c2c3c(ccc21)/C(=N/OC(C)=O)CCO3.CCn1c2ccc(C(=O)c3ccccc3C)cc2c2c3c(ccc21)/C(=N/OC(C)=O)CO3.CCn1c2ccccc2c2c3c(ccc21)/C(=N/OC(C)=O)CCO3.CCn1c2ccccc2c2c3c(ccc21)/C(=N/OC(C)=O)CO3
InChIInChI=1S/C29H27N3O5.C27H24N2O4.C26H22N2O4.C25H20N2O4.C19H18N2O3.C18H16N2O3/c1-3-32-25-10-6-20(28(34)19-4-7-21(8-5-19)31-12-14-35-15-13-31)16-23(25)27-26(32)11-9-22-24(17-36-29(22)27)30-37-18(2)33;1-4-29-23-11-9-18(26(31)19-8-6-5-7-16(19)2)15-21(23)25-24(29)12-10-20-22(28-33-17(3)30)13-14-32-27(20)25;1-4-28-22-11-9-17(25(30)18-8-6-5-7-15(18)2)13-20(22)24-23(28)12-10-19-21(14-31-26(19)24)27-32-16(3)29;1-3-27-21-11-9-17(24(29)16-7-5-4-6-8-16)13-19(21)23-22(27)12-10-18-20(14-30-25(18)23)26-31-15(2)28;1-3-21-16-7-5-4-6-14(16)18-17(21)9-8-13-15(20-24-12(2)22)10-11-23-19(13)18;1-3-20-15-7-5-4-6-13(15)17-16(20)9-8-12-14(10-22-18(12)17)19-23-11(2)21/h4-11,16H,3,12-15,17H2,1-2H3;5-12,15H,4,13-14H2,1-3H3;5-13H,4,14H2,1-3H3;4-13H,3,14H2,1-2H3;4-9H,3,10-11H2,1-2H3;4-9H,3,10H2,1-2H3/b30-24+;28-22+;27-21+;26-20+;20-15+;19-14+
InChIKeyAVAJJWBVIXPVSH-PYDDNQQRSA-N
MW2407.67 g/mol
LogP27.00
Rot. Bonds21

About [(Z)-(9-benzoyl-6-ethylfuro[3,2-c]carbazol-3-ylidene)amino] acetate;[(E)-(7-ethyl-2,3-dihydropyrano[3,2-c]carbazol-4-ylidene)amino] acetate;[(Z)-(6-ethylfuro[3,2-c]carbazol-3-ylidene)amino] acetate;[(E)-[7-ethyl-10-(2-methylbenzoyl)-2,3-dihydropyrano[3,2-c]carbazol-4-ylidene]amino] acetate;[(Z)-[6-ethyl-9-(2-methylbenzoyl)furo[3,2-c]carbazol-3-ylidene]amino] acetate;[(Z)-[6-ethyl-9-(4-morpholin-4-ylbenzoyl)furo[3,2-c]carbazol-3-ylidene]amino] acetate

[(Z)-(9-benzoyl-6-ethylfuro[3,2-c]carbazol-3-ylidene)amino] acetate;[(E)-(7-ethyl-2,3-dihydropyrano[3,2-c]carbazol-4-ylidene)amino] acetate;[(Z)-(6-ethylfuro[3,2-c]carbazol-3-ylidene)amino] acetate;[(E)-[7-ethyl-10-(2-methylbenzoyl)-2,3-dihydropyrano[3,2-c]carbazol-4-ylidene]amino] acetate;[(Z)-[6-ethyl-9-(2-methylbenzoyl)furo[3,2-c]carbazol-3-ylidene]amino] acetate;[(Z)-[6-ethyl-9-(4-morpholin-4-ylbenzoyl)furo[3,2-c]carbazol-3-ylidene]amino] acetate (PubChem CID 172937648) has the molecular formula C144H127N13O23 and a molecular weight of 2407.67 g/mol. Its IUPAC name is [(Z)-(9-benzoyl-6-ethylfuro[3,2-c]carbazol-3-ylidene)amino] acetate;[(E)-(7-ethyl-2,3-dihydropyrano[3,2-c]carbazol-4-ylidene)amino] acetate;[(Z)-(6-ethylfuro[3,2-c]carbazol-3-ylidene)amino] acetate;[(E)-[7-ethyl-10-(2-methylbenzoyl)-2,3-dihydropyrano[3,2-c]carbazol-4-ylidene]amino] acetate;[(Z)-[6-ethyl-9-(2-methylbenzoyl)furo[3,2-c]carbazol-3-ylidene]amino] acetate;[(Z)-[6-ethyl-9-(4-morpholin-4-ylbenzoyl)furo[3,2-c]carbazol-3-ylidene]amino] acetate.

Molecular Properties

Compound Name[(Z)-(9-benzoyl-6-ethylfuro[3,2-c]carbazol-3-ylidene)amino] acetate;[(E)-(7-ethyl-2,3-dihydropyrano[3,2-c]carbazol-4-ylidene)amino] acetate;[(Z)-(6-ethylfuro[3,2-c]carbazol-3-ylidene)amino] acetate;[(E)-[7-ethyl-10-(2-methylbenzoyl)-2,3-dihydropyrano[3,2-c]carbazol-4-ylidene]amino] acetate;[(Z)-[6-ethyl-9-(2-methylbenzoyl)furo[3,2-c]carbazol-3-ylidene]amino] acetate;[(Z)-[6-ethyl-9-(4-morpholin-4-ylbenzoyl)furo[3,2-c]carbazol-3-ylidene]amino] acetate
PubChem CID172937648
Molecular FormulaC144H127N13O23
Molecular Weight2407.67 g/mol
Exact Mass2405.92
IUPAC Name[(Z)-(9-benzoyl-6-ethylfuro[3,2-c]carbazol-3-ylidene)amino] acetate;[(E)-(7-ethyl-2,3-dihydropyrano[3,2-c]carbazol-4-ylidene)amino] acetate;[(Z)-(6-ethylfuro[3,2-c]carbazol-3-ylidene)amino] acetate;[(E)-[7-ethyl-10-(2-methylbenzoyl)-2,3-dihydropyrano[3,2-c]carbazol-4-ylidene]amino] acetate;[(Z)-[6-ethyl-9-(2-methylbenzoyl)furo[3,2-c]carbazol-3-ylidene]amino] acetate;[(Z)-[6-ethyl-9-(4-morpholin-4-ylbenzoyl)furo[3,2-c]carbazol-3-ylidene]amino] acetate
SMILESCCn1c2ccc(C(=O)c3ccc(N4CCOCC4)cc3)cc2c2c3c(ccc21)/C(=N/OC(C)=O)CO3.CCn1c2ccc(C(=O)c3ccccc3)cc2c2c3c(ccc21)/C(=N/OC(C)=O)CO3.CCn1c2ccc(C(=O)c3ccccc3C)cc2c2c3c(ccc21)/C(=N/OC(C)=O)CCO3.CCn1c2ccc(C(=O)c3ccccc3C)cc2c2c3c(ccc21)/C(=N/OC(C)=O)CO3.CCn1c2ccccc2c2c3c(ccc21)/C(=N/OC(C)=O)CCO3.CCn1c2ccccc2c2c3c(ccc21)/C(=N/OC(C)=O)CO3
InChIInChI=1S/C29H27N3O5.C27H24N2O4.C26H22N2O4.C25H20N2O4.C19H18N2O3.C18H16N2O3/c1-3-32-25-10-6-20(28(34)19-4-7-21(8-5-19)31-12-14-35-15-13-31)16-23(25)27-26(32)11-9-22-24(17-36-29(22)27)30-37-18(2)33;1-4-29-23-11-9-18(26(31)19-8-6-5-7-16(19)2)15-21(23)25-24(29)12-10-20-22(28-33-17(3)30)13-14-32-27(20)25;1-4-28-22-11-9-17(25(30)18-8-6-5-7-15(18)2)13-20(22)24-23(28)12-10-19-21(14-31-26(19)24)27-32-16(3)29;1-3-27-21-11-9-17(24(29)16-7-5-4-6-8-16)13-19(21)23-22(27)12-10-18-20(14-30-25(18)23)26-31-15(2)28;1-3-21-16-7-5-4-6-14(16)18-17(21)9-8-13-15(20-24-12(2)22)10-11-23-19(13)18;1-3-20-15-7-5-4-6-13(15)17-16(20)9-8-12-14(10-22-18(12)17)19-23-11(2)21/h4-11,16H,3,12-15,17H2,1-2H3;5-12,15H,4,13-14H2,1-3H3;5-13H,4,14H2,1-3H3;4-13H,3,14H2,1-2H3;4-9H,3,10-11H2,1-2H3;4-9H,3,10H2,1-2H3/b30-24+;28-22+;27-21+;26-20+;20-15+;19-14+
InChIKeyAVAJJWBVIXPVSH-PYDDNQQRSA-N
XLogP27.00
TPSA397.67 Ų
H-Bond Donors
H-Bond Acceptors36
Rotatable Bonds21
Heavy Atoms180
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002407.67
LogP ≤ 527.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1036

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'oxime_2', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze [(Z)-(9-benzoyl-6-ethylfuro[3,2-c]carbazol-3-ylidene)amino] acetate;[(E)-(7-ethyl-2,3-dihydropyrano[3,2-c]carbazol-4-ylidene)amino] acetate;[(Z)-(6-ethylfuro[3,2-c]carbazol-3-ylidene)amino] acetate;[(E)-[7-ethyl-10-(2-methylbenzoyl)-2,3-dihydropyrano[3,2-c]carbazol-4-ylidene]amino] acetate;[(Z)-[6-ethyl-9-(2-methylbenzoyl)furo[3,2-c]carbazol-3-ylidene]amino] acetate;[(Z)-[6-ethyl-9-(4-morpholin-4-ylbenzoyl)furo[3,2-c]carbazol-3-ylidene]amino] acetate with MolForge

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Frequently Asked Questions

What is the IUPAC name of [(Z)-(9-benzoyl-6-ethylfuro[3,2-c]carbazol-3-ylidene)amino] acetate;[(E)-(7-ethyl-2,3-dihydropyrano[3,2-c]carbazol-4-ylidene)amino] acetate;[(Z)-(6-ethylfuro[3,2-c]carbazol-3-ylidene)amino] acetate;[(E)-[7-ethyl-10-(2-methylbenzoyl)-2,3-dihydropyrano[3,2-c]carbazol-4-ylidene]amino] acetate;[(Z)-[6-ethyl-9-(2-methylbenzoyl)furo[3,2-c]carbazol-3-ylidene]amino] acetate;[(Z)-[6-ethyl-9-(4-morpholin-4-ylbenzoyl)furo[3,2-c]carbazol-3-ylidene]amino] acetate?
The IUPAC name of [(Z)-(9-benzoyl-6-ethylfuro[3,2-c]carbazol-3-ylidene)amino] acetate;[(E)-(7-ethyl-2,3-dihydropyrano[3,2-c]carbazol-4-ylidene)amino] acetate;[(Z)-(6-ethylfuro[3,2-c]carbazol-3-ylidene)amino] acetate;[(E)-[7-ethyl-10-(2-methylbenzoyl)-2,3-dihydropyrano[3,2-c]carbazol-4-ylidene]amino] acetate;[(Z)-[6-ethyl-9-(2-methylbenzoyl)furo[3,2-c]carbazol-3-ylidene]amino] acetate;[(Z)-[6-ethyl-9-(4-morpholin-4-ylbenzoyl)furo[3,2-c]carbazol-3-ylidene]amino] acetate (CID 172937648) is [(Z)-(9-benzoyl-6-ethylfuro[3,2-c]carbazol-3-ylidene)amino] acetate;[(E)-(7-ethyl-2,3-dihydropyrano[3,2-c]carbazol-4-ylidene)amino] acetate;[(Z)-(6-ethylfuro[3,2-c]carbazol-3-ylidene)amino] acetate;[(E)-[7-ethyl-10-(2-methylbenzoyl)-2,3-dihydropyrano[3,2-c]carbazol-4-ylidene]amino] acetate;[(Z)-[6-ethyl-9-(2-methylbenzoyl)furo[3,2-c]carbazol-3-ylidene]amino] acetate;[(Z)-[6-ethyl-9-(4-morpholin-4-ylbenzoyl)furo[3,2-c]carbazol-3-ylidene]amino] acetate.
What is the SMILES notation for [(Z)-(9-benzoyl-6-ethylfuro[3,2-c]carbazol-3-ylidene)amino] acetate;[(E)-(7-ethyl-2,3-dihydropyrano[3,2-c]carbazol-4-ylidene)amino] acetate;[(Z)-(6-ethylfuro[3,2-c]carbazol-3-ylidene)amino] acetate;[(E)-[7-ethyl-10-(2-methylbenzoyl)-2,3-dihydropyrano[3,2-c]carbazol-4-ylidene]amino] acetate;[(Z)-[6-ethyl-9-(2-methylbenzoyl)furo[3,2-c]carbazol-3-ylidene]amino] acetate;[(Z)-[6-ethyl-9-(4-morpholin-4-ylbenzoyl)furo[3,2-c]carbazol-3-ylidene]amino] acetate?
The canonical SMILES for [(Z)-(9-benzoyl-6-ethylfuro[3,2-c]carbazol-3-ylidene)amino] acetate;[(E)-(7-ethyl-2,3-dihydropyrano[3,2-c]carbazol-4-ylidene)amino] acetate;[(Z)-(6-ethylfuro[3,2-c]carbazol-3-ylidene)amino] acetate;[(E)-[7-ethyl-10-(2-methylbenzoyl)-2,3-dihydropyrano[3,2-c]carbazol-4-ylidene]amino] acetate;[(Z)-[6-ethyl-9-(2-methylbenzoyl)furo[3,2-c]carbazol-3-ylidene]amino] acetate;[(Z)-[6-ethyl-9-(4-morpholin-4-ylbenzoyl)furo[3,2-c]carbazol-3-ylidene]amino] acetate is CCn1c2ccc(C(=O)c3ccc(N4CCOCC4)cc3)cc2c2c3c(ccc21)/C(=N/OC(C)=O)CO3.CCn1c2ccc(C(=O)c3ccccc3)cc2c2c3c(ccc21)/C(=N/OC(C)=O)CO3.CCn1c2ccc(C(=O)c3ccccc3C)cc2c2c3c(ccc21)/C(=N/OC(C)=O)CCO3.CCn1c2ccc(C(=O)c3ccccc3C)cc2c2c3c(ccc21)/C(=N/OC(C)=O)CO3.CCn1c2ccccc2c2c3c(ccc21)/C(=N/OC(C)=O)CCO3.CCn1c2ccccc2c2c3c(ccc21)/C(=N/OC(C)=O)CO3.
What is the InChIKey of [(Z)-(9-benzoyl-6-ethylfuro[3,2-c]carbazol-3-ylidene)amino] acetate;[(E)-(7-ethyl-2,3-dihydropyrano[3,2-c]carbazol-4-ylidene)amino] acetate;[(Z)-(6-ethylfuro[3,2-c]carbazol-3-ylidene)amino] acetate;[(E)-[7-ethyl-10-(2-methylbenzoyl)-2,3-dihydropyrano[3,2-c]carbazol-4-ylidene]amino] acetate;[(Z)-[6-ethyl-9-(2-methylbenzoyl)furo[3,2-c]carbazol-3-ylidene]amino] acetate;[(Z)-[6-ethyl-9-(4-morpholin-4-ylbenzoyl)furo[3,2-c]carbazol-3-ylidene]amino] acetate?
The InChIKey is AVAJJWBVIXPVSH-PYDDNQQRSA-N. The full InChI is InChI=1S/C29H27N3O5.C27H24N2O4.C26H22N2O4.C25H20N2O4.C19H18N2O3.C18H16N2O3/c1-3-32-25-10-6-20(28(34)19-4-7-21(8-5-19)31-12-14-35-15-13-31)16-23(25)27-26(32)11-9-22-24(17-36-29(22)27)30-37-18(2)33;1-4-29-23-11-9-18(26(31)19-8-6-5-7-16(19)2)15-21(23)25-24(29)12-10-20-22(28-33-17(3)30)13-14-32-27(20)25;1-4-28-22-11-9-17(25(30)18-8-6-5-7-15(18)2)13-20(22)24-23(28)12-10-19-21(14-31-26(19)24)27-32-16(3)29;1-3-27-21-11-9-17(24(29)16-7-5-4-6-8-16)13-19(21)23-22(27)12-10-18-20(14-30-25(18)23)26-31-15(2)28;1-3-21-16-7-5-4-6-14(16)18-17(21)9-8-13-15(20-24-12(2)22)10-11-23-19(13)18;1-3-20-15-7-5-4-6-13(15)17-16(20)9-8-12-14(10-22-18(12)17)19-23-11(2)21/h4-11,16H,3,12-15,17H2,1-2H3;5-12,15H,4,13-14H2,1-3H3;5-13H,4,14H2,1-3H3;4-13H,3,14H2,1-2H3;4-9H,3,10-11H2,1-2H3;4-9H,3,10H2,1-2H3/b30-24+;28-22+;27-21+;26-20+;20-15+;19-14+.
What are the key properties of [(Z)-(9-benzoyl-6-ethylfuro[3,2-c]carbazol-3-ylidene)amino] acetate;[(E)-(7-ethyl-2,3-dihydropyrano[3,2-c]carbazol-4-ylidene)amino] acetate;[(Z)-(6-ethylfuro[3,2-c]carbazol-3-ylidene)amino] acetate;[(E)-[7-ethyl-10-(2-methylbenzoyl)-2,3-dihydropyrano[3,2-c]carbazol-4-ylidene]amino] acetate;[(Z)-[6-ethyl-9-(2-methylbenzoyl)furo[3,2-c]carbazol-3-ylidene]amino] acetate;[(Z)-[6-ethyl-9-(4-morpholin-4-ylbenzoyl)furo[3,2-c]carbazol-3-ylidene]amino] acetate?
[(Z)-(9-benzoyl-6-ethylfuro[3,2-c]carbazol-3-ylidene)amino] acetate;[(E)-(7-ethyl-2,3-dihydropyrano[3,2-c]carbazol-4-ylidene)amino] acetate;[(Z)-(6-ethylfuro[3,2-c]carbazol-3-ylidene)amino] acetate;[(E)-[7-ethyl-10-(2-methylbenzoyl)-2,3-dihydropyrano[3,2-c]carbazol-4-ylidene]amino] acetate;[(Z)-[6-ethyl-9-(2-methylbenzoyl)furo[3,2-c]carbazol-3-ylidene]amino] acetate;[(Z)-[6-ethyl-9-(4-morpholin-4-ylbenzoyl)furo[3,2-c]carbazol-3-ylidene]amino] acetate has a molecular weight of 2407.67 g/mol, XLogP of 27.00, 21 rotatable bonds, 0 hydrogen bond donors, and 36 hydrogen bond acceptors.
Where does this data come from?
All data for [(Z)-(9-benzoyl-6-ethylfuro[3,2-c]carbazol-3-ylidene)amino] acetate;[(E)-(7-ethyl-2,3-dihydropyrano[3,2-c]carbazol-4-ylidene)amino] acetate;[(Z)-(6-ethylfuro[3,2-c]carbazol-3-ylidene)amino] acetate;[(E)-[7-ethyl-10-(2-methylbenzoyl)-2,3-dihydropyrano[3,2-c]carbazol-4-ylidene]amino] acetate;[(Z)-[6-ethyl-9-(2-methylbenzoyl)furo[3,2-c]carbazol-3-ylidene]amino] acetate;[(Z)-[6-ethyl-9-(4-morpholin-4-ylbenzoyl)furo[3,2-c]carbazol-3-ylidene]amino] acetate is sourced from PubChem (CID 172937648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).