15-(10-phenylpyrrolo[2,3-a]carbazol-1-yl)-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[4-(10-phenylpyrrolo[2,3-a]carbazol-1-yl)phenyl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-(3-phenylpyrrolo[3,2-b]carbazol-9-yl)-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-(9-phenylpyrrolo[2,3-b]carbazol-1-yl)-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-(3-phenylpyrrolo[2,3-c]carbazol-6-yl)-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[4-(3-phenylpyrrolo[2,3-c]carbazol-6-yl)phenyl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene

C216H128N24O6 — CID 157389425

IUPAC15-(10-phenylpyrrolo[2,3-a]carbazol-1-yl)-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[4-(10-phenylpyrrolo[2,3-a]carbazol-1-yl)phenyl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-(3-phenylpyrrolo[3,2-b]carbazol-9-yl)-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-(9-phenylpyrrolo[2,3-b]carbazol-1-yl)-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-(3-phenylpyrrolo[2,3-c]carbazol-6-yl)-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[4-(3-phenylpyrrolo[2,3-c]carbazol-6-yl)phenyl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene
SMILESc1ccc(-n2c3ccccc3c3cc4ccn(-c5nc6c7c(cccc7n5)Oc5ccccc5-6)c4cc32)cc1.c1ccc(-n2c3ccccc3c3ccc4ccn(-c5ccc(-c6nc7c8c(cccc8n6)Oc6ccccc6-7)cc5)c4c32)cc1.c1ccc(-n2c3ccccc3c3ccc4ccn(-c5nc6c7c(cccc7n5)Oc5ccccc5-6)c4c32)cc1.c1ccc(-n2ccc3c4c5ccccc5n(-c5ccc(-c6nc7c8c(cccc8n6)Oc6ccccc6-7)cc5)c4ccc32)cc1.c1ccc(-n2ccc3c4c5ccccc5n(-c5nc6c7c(cccc7n5)Oc5ccccc5-6)c4ccc32)cc1.c1ccc(-n2ccc3cc4c(cc32)c2ccccc2n4-c2nc3c4c(cccc4n2)Oc2ccccc2-3)cc1
InChIInChI=1S/2C40H24N4O.4C34H20N4O/c1-2-9-28(10-3-1)44-33-14-6-4-11-29(33)30-22-19-25-23-24-43(38(25)39(30)44)27-20-17-26(18-21-27)40-41-32-13-8-16-35-36(32)37(42-40)31-12-5-7-15-34(31)45-35;1-2-9-26(10-3-1)43-24-23-29-32(43)21-22-34-37(29)28-11-4-6-14-33(28)44(34)27-19-17-25(18-20-27)40-41-31-13-8-16-36-38(31)39(42-40)30-12-5-7-15-35(30)45-36;1-2-9-22(10-3-1)37-18-17-21-19-29-25(20-28(21)37)23-11-4-6-14-27(23)38(29)34-35-26-13-8-16-31-32(26)33(36-34)24-12-5-7-15-30(24)39-31;1-2-9-22(10-3-1)38-27-14-6-4-11-23(27)25-19-21-17-18-37(28(21)20-29(25)38)34-35-26-13-8-16-31-32(26)33(36-34)24-12-5-7-15-30(24)39-31;1-2-9-22(10-3-1)38-27-14-6-4-11-23(27)24-18-17-21-19-20-37(32(21)33(24)38)34-35-26-13-8-16-29-30(26)31(36-34)25-12-5-7-15-28(25)39-29;1-2-9-21(10-3-1)37-20-19-23-26(37)17-18-28-31(23)22-11-4-6-14-27(22)38(28)34-35-25-13-8-16-30-32(25)33(36-34)24-12-5-7-15-29(24)39-30/h2*1-24H;4*1-20H
InChIKeyBLVBHKLSNCVEIT-UHFFFAOYSA-N
MW3155.56 g/mol
LogP53.99
Rot. Bonds14

About 15-(10-phenylpyrrolo[2,3-a]carbazol-1-yl)-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[4-(10-phenylpyrrolo[2,3-a]carbazol-1-yl)phenyl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-(3-phenylpyrrolo[3,2-b]carbazol-9-yl)-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-(9-phenylpyrrolo[2,3-b]carbazol-1-yl)-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-(3-phenylpyrrolo[2,3-c]carbazol-6-yl)-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[4-(3-phenylpyrrolo[2,3-c]carbazol-6-yl)phenyl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene

15-(10-phenylpyrrolo[2,3-a]carbazol-1-yl)-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[4-(10-phenylpyrrolo[2,3-a]carbazol-1-yl)phenyl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-(3-phenylpyrrolo[3,2-b]carbazol-9-yl)-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-(9-phenylpyrrolo[2,3-b]carbazol-1-yl)-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-(3-phenylpyrrolo[2,3-c]carbazol-6-yl)-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[4-(3-phenylpyrrolo[2,3-c]carbazol-6-yl)phenyl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene (PubChem CID 157389425) has the molecular formula C216H128N24O6 and a molecular weight of 3155.56 g/mol. Its IUPAC name is 15-(10-phenylpyrrolo[2,3-a]carbazol-1-yl)-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[4-(10-phenylpyrrolo[2,3-a]carbazol-1-yl)phenyl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-(3-phenylpyrrolo[3,2-b]carbazol-9-yl)-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-(9-phenylpyrrolo[2,3-b]carbazol-1-yl)-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-(3-phenylpyrrolo[2,3-c]carbazol-6-yl)-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[4-(3-phenylpyrrolo[2,3-c]carbazol-6-yl)phenyl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene.

Molecular Properties

Compound Name15-(10-phenylpyrrolo[2,3-a]carbazol-1-yl)-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[4-(10-phenylpyrrolo[2,3-a]carbazol-1-yl)phenyl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-(3-phenylpyrrolo[3,2-b]carbazol-9-yl)-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-(9-phenylpyrrolo[2,3-b]carbazol-1-yl)-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-(3-phenylpyrrolo[2,3-c]carbazol-6-yl)-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[4-(3-phenylpyrrolo[2,3-c]carbazol-6-yl)phenyl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene
PubChem CID157389425
Molecular FormulaC216H128N24O6
Molecular Weight3155.56 g/mol
Exact Mass3153.04
IUPAC Name15-(10-phenylpyrrolo[2,3-a]carbazol-1-yl)-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[4-(10-phenylpyrrolo[2,3-a]carbazol-1-yl)phenyl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-(3-phenylpyrrolo[3,2-b]carbazol-9-yl)-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-(9-phenylpyrrolo[2,3-b]carbazol-1-yl)-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-(3-phenylpyrrolo[2,3-c]carbazol-6-yl)-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[4-(3-phenylpyrrolo[2,3-c]carbazol-6-yl)phenyl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene
SMILESc1ccc(-n2c3ccccc3c3cc4ccn(-c5nc6c7c(cccc7n5)Oc5ccccc5-6)c4cc32)cc1.c1ccc(-n2c3ccccc3c3ccc4ccn(-c5ccc(-c6nc7c8c(cccc8n6)Oc6ccccc6-7)cc5)c4c32)cc1.c1ccc(-n2c3ccccc3c3ccc4ccn(-c5nc6c7c(cccc7n5)Oc5ccccc5-6)c4c32)cc1.c1ccc(-n2ccc3c4c5ccccc5n(-c5ccc(-c6nc7c8c(cccc8n6)Oc6ccccc6-7)cc5)c4ccc32)cc1.c1ccc(-n2ccc3c4c5ccccc5n(-c5nc6c7c(cccc7n5)Oc5ccccc5-6)c4ccc32)cc1.c1ccc(-n2ccc3cc4c(cc32)c2ccccc2n4-c2nc3c4c(cccc4n2)Oc2ccccc2-3)cc1
InChIInChI=1S/2C40H24N4O.4C34H20N4O/c1-2-9-28(10-3-1)44-33-14-6-4-11-29(33)30-22-19-25-23-24-43(38(25)39(30)44)27-20-17-26(18-21-27)40-41-32-13-8-16-35-36(32)37(42-40)31-12-5-7-15-34(31)45-35;1-2-9-26(10-3-1)43-24-23-29-32(43)21-22-34-37(29)28-11-4-6-14-33(28)44(34)27-19-17-25(18-20-27)40-41-31-13-8-16-36-38(31)39(42-40)30-12-5-7-15-35(30)45-36;1-2-9-22(10-3-1)37-18-17-21-19-29-25(20-28(21)37)23-11-4-6-14-27(23)38(29)34-35-26-13-8-16-31-32(26)33(36-34)24-12-5-7-15-30(24)39-31;1-2-9-22(10-3-1)38-27-14-6-4-11-23(27)25-19-21-17-18-37(28(21)20-29(25)38)34-35-26-13-8-16-31-32(26)33(36-34)24-12-5-7-15-30(24)39-31;1-2-9-22(10-3-1)38-27-14-6-4-11-23(27)24-18-17-21-19-20-37(32(21)33(24)38)34-35-26-13-8-16-29-30(26)31(36-34)25-12-5-7-15-28(25)39-29;1-2-9-21(10-3-1)37-20-19-23-26(37)17-18-28-31(23)22-11-4-6-14-27(22)38(28)34-35-25-13-8-16-30-32(25)33(36-34)24-12-5-7-15-29(24)39-30/h2*1-24H;4*1-20H
InChIKeyBLVBHKLSNCVEIT-UHFFFAOYSA-N
XLogP53.99
TPSA269.22 Ų
H-Bond Donors
H-Bond Acceptors30
Rotatable Bonds14
Heavy Atoms246
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003155.56
LogP ≤ 553.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1030

Analyze 15-(10-phenylpyrrolo[2,3-a]carbazol-1-yl)-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[4-(10-phenylpyrrolo[2,3-a]carbazol-1-yl)phenyl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-(3-phenylpyrrolo[3,2-b]carbazol-9-yl)-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-(9-phenylpyrrolo[2,3-b]carbazol-1-yl)-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-(3-phenylpyrrolo[2,3-c]carbazol-6-yl)-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[4-(3-phenylpyrrolo[2,3-c]carbazol-6-yl)phenyl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene with MolForge

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bis(6-methyl-5-[[3-[9-(oxan-2-yl)purin-6-yl]-2-pyridinyl]methyl]-N-[3-(trifluoromethoxy)phenyl]isoquinolin-1-amine);6-methyl-1-N-[3-(trifluoromethoxy)phenyl]isoquinoline-1,5-diamine
CID 159026080
N,N-dimethyl-2-[3-[6-methyl-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]benzene-2-id-1-yl]oxypyridin-4-amine;N,N-dimethyl-2-[3-[6-methyl-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]-5-(trifluoromethyl)benzene-2-id-1-yl]oxypyridin-4-amine;N,N-dimethyl-2-[3-[9-(4-methyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]-5-(trifluoromethyl)benzene-2-id-1-yl]oxypyridin-4-amine;pentakis(platinum(2+));N,N,5-trimethyl-2-[3-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)benzene-2-id-1-yl]oxypyridin-3-amine;N,N,5-trimethyl-2-[3-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)benzene-2-id-1-yl]oxypyridin-4-amine
CID 159430460

Frequently Asked Questions

What is the IUPAC name of 15-(10-phenylpyrrolo[2,3-a]carbazol-1-yl)-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[4-(10-phenylpyrrolo[2,3-a]carbazol-1-yl)phenyl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-(3-phenylpyrrolo[3,2-b]carbazol-9-yl)-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-(9-phenylpyrrolo[2,3-b]carbazol-1-yl)-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-(3-phenylpyrrolo[2,3-c]carbazol-6-yl)-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[4-(3-phenylpyrrolo[2,3-c]carbazol-6-yl)phenyl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene?
The IUPAC name of 15-(10-phenylpyrrolo[2,3-a]carbazol-1-yl)-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[4-(10-phenylpyrrolo[2,3-a]carbazol-1-yl)phenyl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-(3-phenylpyrrolo[3,2-b]carbazol-9-yl)-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-(9-phenylpyrrolo[2,3-b]carbazol-1-yl)-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-(3-phenylpyrrolo[2,3-c]carbazol-6-yl)-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[4-(3-phenylpyrrolo[2,3-c]carbazol-6-yl)phenyl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene (CID 157389425) is 15-(10-phenylpyrrolo[2,3-a]carbazol-1-yl)-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[4-(10-phenylpyrrolo[2,3-a]carbazol-1-yl)phenyl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-(3-phenylpyrrolo[3,2-b]carbazol-9-yl)-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-(9-phenylpyrrolo[2,3-b]carbazol-1-yl)-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-(3-phenylpyrrolo[2,3-c]carbazol-6-yl)-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[4-(3-phenylpyrrolo[2,3-c]carbazol-6-yl)phenyl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene.
What is the SMILES notation for 15-(10-phenylpyrrolo[2,3-a]carbazol-1-yl)-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[4-(10-phenylpyrrolo[2,3-a]carbazol-1-yl)phenyl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-(3-phenylpyrrolo[3,2-b]carbazol-9-yl)-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-(9-phenylpyrrolo[2,3-b]carbazol-1-yl)-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-(3-phenylpyrrolo[2,3-c]carbazol-6-yl)-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[4-(3-phenylpyrrolo[2,3-c]carbazol-6-yl)phenyl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene?
The canonical SMILES for 15-(10-phenylpyrrolo[2,3-a]carbazol-1-yl)-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[4-(10-phenylpyrrolo[2,3-a]carbazol-1-yl)phenyl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-(3-phenylpyrrolo[3,2-b]carbazol-9-yl)-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-(9-phenylpyrrolo[2,3-b]carbazol-1-yl)-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-(3-phenylpyrrolo[2,3-c]carbazol-6-yl)-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[4-(3-phenylpyrrolo[2,3-c]carbazol-6-yl)phenyl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene is c1ccc(-n2c3ccccc3c3cc4ccn(-c5nc6c7c(cccc7n5)Oc5ccccc5-6)c4cc32)cc1.c1ccc(-n2c3ccccc3c3ccc4ccn(-c5ccc(-c6nc7c8c(cccc8n6)Oc6ccccc6-7)cc5)c4c32)cc1.c1ccc(-n2c3ccccc3c3ccc4ccn(-c5nc6c7c(cccc7n5)Oc5ccccc5-6)c4c32)cc1.c1ccc(-n2ccc3c4c5ccccc5n(-c5ccc(-c6nc7c8c(cccc8n6)Oc6ccccc6-7)cc5)c4ccc32)cc1.c1ccc(-n2ccc3c4c5ccccc5n(-c5nc6c7c(cccc7n5)Oc5ccccc5-6)c4ccc32)cc1.c1ccc(-n2ccc3cc4c(cc32)c2ccccc2n4-c2nc3c4c(cccc4n2)Oc2ccccc2-3)cc1.
What is the InChIKey of 15-(10-phenylpyrrolo[2,3-a]carbazol-1-yl)-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[4-(10-phenylpyrrolo[2,3-a]carbazol-1-yl)phenyl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-(3-phenylpyrrolo[3,2-b]carbazol-9-yl)-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-(9-phenylpyrrolo[2,3-b]carbazol-1-yl)-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-(3-phenylpyrrolo[2,3-c]carbazol-6-yl)-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[4-(3-phenylpyrrolo[2,3-c]carbazol-6-yl)phenyl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene?
The InChIKey is BLVBHKLSNCVEIT-UHFFFAOYSA-N. The full InChI is InChI=1S/2C40H24N4O.4C34H20N4O/c1-2-9-28(10-3-1)44-33-14-6-4-11-29(33)30-22-19-25-23-24-43(38(25)39(30)44)27-20-17-26(18-21-27)40-41-32-13-8-16-35-36(32)37(42-40)31-12-5-7-15-34(31)45-35;1-2-9-26(10-3-1)43-24-23-29-32(43)21-22-34-37(29)28-11-4-6-14-33(28)44(34)27-19-17-25(18-20-27)40-41-31-13-8-16-36-38(31)39(42-40)30-12-5-7-15-35(30)45-36;1-2-9-22(10-3-1)37-18-17-21-19-29-25(20-28(21)37)23-11-4-6-14-27(23)38(29)34-35-26-13-8-16-31-32(26)33(36-34)24-12-5-7-15-30(24)39-31;1-2-9-22(10-3-1)38-27-14-6-4-11-23(27)25-19-21-17-18-37(28(21)20-29(25)38)34-35-26-13-8-16-31-32(26)33(36-34)24-12-5-7-15-30(24)39-31;1-2-9-22(10-3-1)38-27-14-6-4-11-23(27)24-18-17-21-19-20-37(32(21)33(24)38)34-35-26-13-8-16-29-30(26)31(36-34)25-12-5-7-15-28(25)39-29;1-2-9-21(10-3-1)37-20-19-23-26(37)17-18-28-31(23)22-11-4-6-14-27(22)38(28)34-35-25-13-8-16-30-32(25)33(36-34)24-12-5-7-15-29(24)39-30/h2*1-24H;4*1-20H.
What are the key properties of 15-(10-phenylpyrrolo[2,3-a]carbazol-1-yl)-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[4-(10-phenylpyrrolo[2,3-a]carbazol-1-yl)phenyl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-(3-phenylpyrrolo[3,2-b]carbazol-9-yl)-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-(9-phenylpyrrolo[2,3-b]carbazol-1-yl)-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-(3-phenylpyrrolo[2,3-c]carbazol-6-yl)-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[4-(3-phenylpyrrolo[2,3-c]carbazol-6-yl)phenyl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene?
15-(10-phenylpyrrolo[2,3-a]carbazol-1-yl)-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[4-(10-phenylpyrrolo[2,3-a]carbazol-1-yl)phenyl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-(3-phenylpyrrolo[3,2-b]carbazol-9-yl)-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-(9-phenylpyrrolo[2,3-b]carbazol-1-yl)-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-(3-phenylpyrrolo[2,3-c]carbazol-6-yl)-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[4-(3-phenylpyrrolo[2,3-c]carbazol-6-yl)phenyl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene has a molecular weight of 3155.56 g/mol, XLogP of 53.99, 14 rotatable bonds, 0 hydrogen bond donors, and 30 hydrogen bond acceptors.
Where does this data come from?
All data for 15-(10-phenylpyrrolo[2,3-a]carbazol-1-yl)-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[4-(10-phenylpyrrolo[2,3-a]carbazol-1-yl)phenyl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-(3-phenylpyrrolo[3,2-b]carbazol-9-yl)-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-(9-phenylpyrrolo[2,3-b]carbazol-1-yl)-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-(3-phenylpyrrolo[2,3-c]carbazol-6-yl)-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[4-(3-phenylpyrrolo[2,3-c]carbazol-6-yl)phenyl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene is sourced from PubChem (CID 157389425), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).