13-(3,5-diphenylphenyl)-7,7-dimethyl-12-phenylindolo[3,2-c]acridine;12-(3,5-diphenylphenyl)-13-phenylindolo[2,3-a]phenothiazine;12-(3,5-diphenylphenyl)-13-phenylindolo[2,3-a]phenoxazine;5-[4-(4-phenylphenyl)phenyl]-[1]benzothiolo[3,2-c]carbazole;12-(3-phenylphenyl)-5-(4-phenylphenyl)indolo[3,2-c]phenothiazine;12-(3-phenylphenyl)-5-(4-phenylphenyl)indolo[3,2-c]phenoxazine

C249H169N11O2S3 — CID 157387392

IUPAC13-(3,5-diphenylphenyl)-7,7-dimethyl-12-phenylindolo[3,2-c]acridine;12-(3,5-diphenylphenyl)-13-phenylindolo[2,3-a]phenothiazine;12-(3,5-diphenylphenyl)-13-phenylindolo[2,3-a]phenoxazine;5-[4-(4-phenylphenyl)phenyl]-[1]benzothiolo[3,2-c]carbazole;12-(3-phenylphenyl)-5-(4-phenylphenyl)indolo[3,2-c]phenothiazine;12-(3-phenylphenyl)-5-(4-phenylphenyl)indolo[3,2-c]phenoxazine
SMILESCC1(C)c2ccccc2N(c2ccccc2)c2c1ccc1c3ccccc3n(-c3cc(-c4ccccc4)cc(-c4ccccc4)c3)c21.c1ccc(-c2cc(-c3ccccc3)cc(-n3c4ccccc4c4ccc5c(c43)N(c3ccccc3)c3ccccc3O5)c2)cc1.c1ccc(-c2cc(-c3ccccc3)cc(-n3c4ccccc4c4ccc5c(c43)N(c3ccccc3)c3ccccc3S5)c2)cc1.c1ccc(-c2ccc(-c3ccc(-n4c5ccccc5c5c6sc7ccccc7c6ccc54)cc3)cc2)cc1.c1ccc(-c2ccc(N3c4ccccc4Oc4c3ccc3c5ccccc5n(-c5cccc(-c6ccccc6)c5)c43)cc2)cc1.c1ccc(-c2ccc(N3c4ccccc4Sc4c3ccc3c5ccccc5n(-c5cccc(-c6ccccc6)c5)c43)cc2)cc1
InChIInChI=1S/C45H34N2.2C42H28N2O.2C42H28N2S.C36H23NS/c1-45(2)39-23-13-15-25-42(39)46(35-20-10-5-11-21-35)44-40(45)27-26-38-37-22-12-14-24-41(37)47(43(38)44)36-29-33(31-16-6-3-7-17-31)28-34(30-36)32-18-8-4-9-19-32;1-4-14-29(15-5-1)31-26-32(30-16-6-2-7-17-30)28-34(27-31)44-37-21-11-10-20-35(37)36-24-25-40-42(41(36)44)43(33-18-8-3-9-19-33)38-22-12-13-23-39(38)45-40;1-3-12-29(13-4-1)31-22-24-33(25-23-31)43-38-20-9-10-21-40(38)45-42-39(43)27-26-36-35-18-7-8-19-37(35)44(41(36)42)34-17-11-16-32(28-34)30-14-5-2-6-15-30;1-4-14-29(15-5-1)31-26-32(30-16-6-2-7-17-30)28-34(27-31)44-37-21-11-10-20-35(37)36-24-25-40-42(41(36)44)43(33-18-8-3-9-19-33)38-22-12-13-23-39(38)45-40;1-3-12-29(13-4-1)31-22-24-33(25-23-31)43-38-20-9-10-21-40(38)45-42-39(43)27-26-36-35-18-7-8-19-37(35)44(41(36)42)34-17-11-16-32(28-34)30-14-5-2-6-15-30;1-2-8-24(9-3-1)25-14-16-26(17-15-25)27-18-20-28(21-19-27)37-32-12-6-4-11-31(32)35-33(37)23-22-30-29-10-5-7-13-34(29)38-36(30)35/h3-30H,1-2H3;4*1-28H;1-23H
InChIKeyBLPBUKROCQDVPU-UHFFFAOYSA-N
MW3443.37 g/mol
LogP70.20
Rot. Bonds23

About 13-(3,5-diphenylphenyl)-7,7-dimethyl-12-phenylindolo[3,2-c]acridine;12-(3,5-diphenylphenyl)-13-phenylindolo[2,3-a]phenothiazine;12-(3,5-diphenylphenyl)-13-phenylindolo[2,3-a]phenoxazine;5-[4-(4-phenylphenyl)phenyl]-[1]benzothiolo[3,2-c]carbazole;12-(3-phenylphenyl)-5-(4-phenylphenyl)indolo[3,2-c]phenothiazine;12-(3-phenylphenyl)-5-(4-phenylphenyl)indolo[3,2-c]phenoxazine

13-(3,5-diphenylphenyl)-7,7-dimethyl-12-phenylindolo[3,2-c]acridine;12-(3,5-diphenylphenyl)-13-phenylindolo[2,3-a]phenothiazine;12-(3,5-diphenylphenyl)-13-phenylindolo[2,3-a]phenoxazine;5-[4-(4-phenylphenyl)phenyl]-[1]benzothiolo[3,2-c]carbazole;12-(3-phenylphenyl)-5-(4-phenylphenyl)indolo[3,2-c]phenothiazine;12-(3-phenylphenyl)-5-(4-phenylphenyl)indolo[3,2-c]phenoxazine (PubChem CID 157387392) has the molecular formula C249H169N11O2S3 and a molecular weight of 3443.37 g/mol. Its IUPAC name is 13-(3,5-diphenylphenyl)-7,7-dimethyl-12-phenylindolo[3,2-c]acridine;12-(3,5-diphenylphenyl)-13-phenylindolo[2,3-a]phenothiazine;12-(3,5-diphenylphenyl)-13-phenylindolo[2,3-a]phenoxazine;5-[4-(4-phenylphenyl)phenyl]-[1]benzothiolo[3,2-c]carbazole;12-(3-phenylphenyl)-5-(4-phenylphenyl)indolo[3,2-c]phenothiazine;12-(3-phenylphenyl)-5-(4-phenylphenyl)indolo[3,2-c]phenoxazine.

Molecular Properties

Compound Name13-(3,5-diphenylphenyl)-7,7-dimethyl-12-phenylindolo[3,2-c]acridine;12-(3,5-diphenylphenyl)-13-phenylindolo[2,3-a]phenothiazine;12-(3,5-diphenylphenyl)-13-phenylindolo[2,3-a]phenoxazine;5-[4-(4-phenylphenyl)phenyl]-[1]benzothiolo[3,2-c]carbazole;12-(3-phenylphenyl)-5-(4-phenylphenyl)indolo[3,2-c]phenothiazine;12-(3-phenylphenyl)-5-(4-phenylphenyl)indolo[3,2-c]phenoxazine
PubChem CID157387392
Molecular FormulaC249H169N11O2S3
Molecular Weight3443.37 g/mol
Exact Mass3440.26
IUPAC Name13-(3,5-diphenylphenyl)-7,7-dimethyl-12-phenylindolo[3,2-c]acridine;12-(3,5-diphenylphenyl)-13-phenylindolo[2,3-a]phenothiazine;12-(3,5-diphenylphenyl)-13-phenylindolo[2,3-a]phenoxazine;5-[4-(4-phenylphenyl)phenyl]-[1]benzothiolo[3,2-c]carbazole;12-(3-phenylphenyl)-5-(4-phenylphenyl)indolo[3,2-c]phenothiazine;12-(3-phenylphenyl)-5-(4-phenylphenyl)indolo[3,2-c]phenoxazine
SMILESCC1(C)c2ccccc2N(c2ccccc2)c2c1ccc1c3ccccc3n(-c3cc(-c4ccccc4)cc(-c4ccccc4)c3)c21.c1ccc(-c2cc(-c3ccccc3)cc(-n3c4ccccc4c4ccc5c(c43)N(c3ccccc3)c3ccccc3O5)c2)cc1.c1ccc(-c2cc(-c3ccccc3)cc(-n3c4ccccc4c4ccc5c(c43)N(c3ccccc3)c3ccccc3S5)c2)cc1.c1ccc(-c2ccc(-c3ccc(-n4c5ccccc5c5c6sc7ccccc7c6ccc54)cc3)cc2)cc1.c1ccc(-c2ccc(N3c4ccccc4Oc4c3ccc3c5ccccc5n(-c5cccc(-c6ccccc6)c5)c43)cc2)cc1.c1ccc(-c2ccc(N3c4ccccc4Sc4c3ccc3c5ccccc5n(-c5cccc(-c6ccccc6)c5)c43)cc2)cc1
InChIInChI=1S/C45H34N2.2C42H28N2O.2C42H28N2S.C36H23NS/c1-45(2)39-23-13-15-25-42(39)46(35-20-10-5-11-21-35)44-40(45)27-26-38-37-22-12-14-24-41(37)47(43(38)44)36-29-33(31-16-6-3-7-17-31)28-34(30-36)32-18-8-4-9-19-32;1-4-14-29(15-5-1)31-26-32(30-16-6-2-7-17-30)28-34(27-31)44-37-21-11-10-20-35(37)36-24-25-40-42(41(36)44)43(33-18-8-3-9-19-33)38-22-12-13-23-39(38)45-40;1-3-12-29(13-4-1)31-22-24-33(25-23-31)43-38-20-9-10-21-40(38)45-42-39(43)27-26-36-35-18-7-8-19-37(35)44(41(36)42)34-17-11-16-32(28-34)30-14-5-2-6-15-30;1-4-14-29(15-5-1)31-26-32(30-16-6-2-7-17-30)28-34(27-31)44-37-21-11-10-20-35(37)36-24-25-40-42(41(36)44)43(33-18-8-3-9-19-33)38-22-12-13-23-39(38)45-40;1-3-12-29(13-4-1)31-22-24-33(25-23-31)43-38-20-9-10-21-40(38)45-42-39(43)27-26-36-35-18-7-8-19-37(35)44(41(36)42)34-17-11-16-32(28-34)30-14-5-2-6-15-30;1-2-8-24(9-3-1)25-14-16-26(17-15-25)27-18-20-28(21-19-27)37-32-12-6-4-11-31(32)35-33(37)23-22-30-29-10-5-7-13-34(29)38-36(30)35/h3-30H,1-2H3;4*1-28H;1-23H
InChIKeyBLPBUKROCQDVPU-UHFFFAOYSA-N
XLogP70.20
TPSA64.24 Ų
H-Bond Donors
H-Bond Acceptors16
Rotatable Bonds23
Heavy Atoms265
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003443.37
LogP ≤ 570.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1016

Analyze 13-(3,5-diphenylphenyl)-7,7-dimethyl-12-phenylindolo[3,2-c]acridine;12-(3,5-diphenylphenyl)-13-phenylindolo[2,3-a]phenothiazine;12-(3,5-diphenylphenyl)-13-phenylindolo[2,3-a]phenoxazine;5-[4-(4-phenylphenyl)phenyl]-[1]benzothiolo[3,2-c]carbazole;12-(3-phenylphenyl)-5-(4-phenylphenyl)indolo[3,2-c]phenothiazine;12-(3-phenylphenyl)-5-(4-phenylphenyl)indolo[3,2-c]phenoxazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Frequently Asked Questions

What is the IUPAC name of 13-(3,5-diphenylphenyl)-7,7-dimethyl-12-phenylindolo[3,2-c]acridine;12-(3,5-diphenylphenyl)-13-phenylindolo[2,3-a]phenothiazine;12-(3,5-diphenylphenyl)-13-phenylindolo[2,3-a]phenoxazine;5-[4-(4-phenylphenyl)phenyl]-[1]benzothiolo[3,2-c]carbazole;12-(3-phenylphenyl)-5-(4-phenylphenyl)indolo[3,2-c]phenothiazine;12-(3-phenylphenyl)-5-(4-phenylphenyl)indolo[3,2-c]phenoxazine?
The IUPAC name of 13-(3,5-diphenylphenyl)-7,7-dimethyl-12-phenylindolo[3,2-c]acridine;12-(3,5-diphenylphenyl)-13-phenylindolo[2,3-a]phenothiazine;12-(3,5-diphenylphenyl)-13-phenylindolo[2,3-a]phenoxazine;5-[4-(4-phenylphenyl)phenyl]-[1]benzothiolo[3,2-c]carbazole;12-(3-phenylphenyl)-5-(4-phenylphenyl)indolo[3,2-c]phenothiazine;12-(3-phenylphenyl)-5-(4-phenylphenyl)indolo[3,2-c]phenoxazine (CID 157387392) is 13-(3,5-diphenylphenyl)-7,7-dimethyl-12-phenylindolo[3,2-c]acridine;12-(3,5-diphenylphenyl)-13-phenylindolo[2,3-a]phenothiazine;12-(3,5-diphenylphenyl)-13-phenylindolo[2,3-a]phenoxazine;5-[4-(4-phenylphenyl)phenyl]-[1]benzothiolo[3,2-c]carbazole;12-(3-phenylphenyl)-5-(4-phenylphenyl)indolo[3,2-c]phenothiazine;12-(3-phenylphenyl)-5-(4-phenylphenyl)indolo[3,2-c]phenoxazine.
What is the SMILES notation for 13-(3,5-diphenylphenyl)-7,7-dimethyl-12-phenylindolo[3,2-c]acridine;12-(3,5-diphenylphenyl)-13-phenylindolo[2,3-a]phenothiazine;12-(3,5-diphenylphenyl)-13-phenylindolo[2,3-a]phenoxazine;5-[4-(4-phenylphenyl)phenyl]-[1]benzothiolo[3,2-c]carbazole;12-(3-phenylphenyl)-5-(4-phenylphenyl)indolo[3,2-c]phenothiazine;12-(3-phenylphenyl)-5-(4-phenylphenyl)indolo[3,2-c]phenoxazine?
The canonical SMILES for 13-(3,5-diphenylphenyl)-7,7-dimethyl-12-phenylindolo[3,2-c]acridine;12-(3,5-diphenylphenyl)-13-phenylindolo[2,3-a]phenothiazine;12-(3,5-diphenylphenyl)-13-phenylindolo[2,3-a]phenoxazine;5-[4-(4-phenylphenyl)phenyl]-[1]benzothiolo[3,2-c]carbazole;12-(3-phenylphenyl)-5-(4-phenylphenyl)indolo[3,2-c]phenothiazine;12-(3-phenylphenyl)-5-(4-phenylphenyl)indolo[3,2-c]phenoxazine is CC1(C)c2ccccc2N(c2ccccc2)c2c1ccc1c3ccccc3n(-c3cc(-c4ccccc4)cc(-c4ccccc4)c3)c21.c1ccc(-c2cc(-c3ccccc3)cc(-n3c4ccccc4c4ccc5c(c43)N(c3ccccc3)c3ccccc3O5)c2)cc1.c1ccc(-c2cc(-c3ccccc3)cc(-n3c4ccccc4c4ccc5c(c43)N(c3ccccc3)c3ccccc3S5)c2)cc1.c1ccc(-c2ccc(-c3ccc(-n4c5ccccc5c5c6sc7ccccc7c6ccc54)cc3)cc2)cc1.c1ccc(-c2ccc(N3c4ccccc4Oc4c3ccc3c5ccccc5n(-c5cccc(-c6ccccc6)c5)c43)cc2)cc1.c1ccc(-c2ccc(N3c4ccccc4Sc4c3ccc3c5ccccc5n(-c5cccc(-c6ccccc6)c5)c43)cc2)cc1.
What is the InChIKey of 13-(3,5-diphenylphenyl)-7,7-dimethyl-12-phenylindolo[3,2-c]acridine;12-(3,5-diphenylphenyl)-13-phenylindolo[2,3-a]phenothiazine;12-(3,5-diphenylphenyl)-13-phenylindolo[2,3-a]phenoxazine;5-[4-(4-phenylphenyl)phenyl]-[1]benzothiolo[3,2-c]carbazole;12-(3-phenylphenyl)-5-(4-phenylphenyl)indolo[3,2-c]phenothiazine;12-(3-phenylphenyl)-5-(4-phenylphenyl)indolo[3,2-c]phenoxazine?
The InChIKey is BLPBUKROCQDVPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C45H34N2.2C42H28N2O.2C42H28N2S.C36H23NS/c1-45(2)39-23-13-15-25-42(39)46(35-20-10-5-11-21-35)44-40(45)27-26-38-37-22-12-14-24-41(37)47(43(38)44)36-29-33(31-16-6-3-7-17-31)28-34(30-36)32-18-8-4-9-19-32;1-4-14-29(15-5-1)31-26-32(30-16-6-2-7-17-30)28-34(27-31)44-37-21-11-10-20-35(37)36-24-25-40-42(41(36)44)43(33-18-8-3-9-19-33)38-22-12-13-23-39(38)45-40;1-3-12-29(13-4-1)31-22-24-33(25-23-31)43-38-20-9-10-21-40(38)45-42-39(43)27-26-36-35-18-7-8-19-37(35)44(41(36)42)34-17-11-16-32(28-34)30-14-5-2-6-15-30;1-4-14-29(15-5-1)31-26-32(30-16-6-2-7-17-30)28-34(27-31)44-37-21-11-10-20-35(37)36-24-25-40-42(41(36)44)43(33-18-8-3-9-19-33)38-22-12-13-23-39(38)45-40;1-3-12-29(13-4-1)31-22-24-33(25-23-31)43-38-20-9-10-21-40(38)45-42-39(43)27-26-36-35-18-7-8-19-37(35)44(41(36)42)34-17-11-16-32(28-34)30-14-5-2-6-15-30;1-2-8-24(9-3-1)25-14-16-26(17-15-25)27-18-20-28(21-19-27)37-32-12-6-4-11-31(32)35-33(37)23-22-30-29-10-5-7-13-34(29)38-36(30)35/h3-30H,1-2H3;4*1-28H;1-23H.
What are the key properties of 13-(3,5-diphenylphenyl)-7,7-dimethyl-12-phenylindolo[3,2-c]acridine;12-(3,5-diphenylphenyl)-13-phenylindolo[2,3-a]phenothiazine;12-(3,5-diphenylphenyl)-13-phenylindolo[2,3-a]phenoxazine;5-[4-(4-phenylphenyl)phenyl]-[1]benzothiolo[3,2-c]carbazole;12-(3-phenylphenyl)-5-(4-phenylphenyl)indolo[3,2-c]phenothiazine;12-(3-phenylphenyl)-5-(4-phenylphenyl)indolo[3,2-c]phenoxazine?
13-(3,5-diphenylphenyl)-7,7-dimethyl-12-phenylindolo[3,2-c]acridine;12-(3,5-diphenylphenyl)-13-phenylindolo[2,3-a]phenothiazine;12-(3,5-diphenylphenyl)-13-phenylindolo[2,3-a]phenoxazine;5-[4-(4-phenylphenyl)phenyl]-[1]benzothiolo[3,2-c]carbazole;12-(3-phenylphenyl)-5-(4-phenylphenyl)indolo[3,2-c]phenothiazine;12-(3-phenylphenyl)-5-(4-phenylphenyl)indolo[3,2-c]phenoxazine has a molecular weight of 3443.37 g/mol, XLogP of 70.20, 23 rotatable bonds, 0 hydrogen bond donors, and 16 hydrogen bond acceptors.
Where does this data come from?
All data for 13-(3,5-diphenylphenyl)-7,7-dimethyl-12-phenylindolo[3,2-c]acridine;12-(3,5-diphenylphenyl)-13-phenylindolo[2,3-a]phenothiazine;12-(3,5-diphenylphenyl)-13-phenylindolo[2,3-a]phenoxazine;5-[4-(4-phenylphenyl)phenyl]-[1]benzothiolo[3,2-c]carbazole;12-(3-phenylphenyl)-5-(4-phenylphenyl)indolo[3,2-c]phenothiazine;12-(3-phenylphenyl)-5-(4-phenylphenyl)indolo[3,2-c]phenoxazine is sourced from PubChem (CID 157387392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).