200,000+ products from a single source!
sales@angenechem.com
Home > Indoles and Oxindole > 83721-62-4
83721-62-4 | 8,25-DIHYDRO-5H-NAPHTH(2',3':6,7)INDOLO(2,3-C)DINAPHTHO(2,3-I:2',3'-I')BENZO(1,2-A:4,5-A')DICARBAZOLE-5,7,9,14,19,24,26,31(6H)-OCTONE
CAS No: 83721-62-4 Catalog No: AG004XPG MDL No:
Product Description
Catalog Number:
AG004XPG
Chemical Name:
8,25-DIHYDRO-5H-NAPHTH(2',3':6,7)INDOLO(2,3-C)DINAPHTHO(2,3-I:2',3'-I')BENZO(1,2-A:4,5-A')DICARBAZOLE-5,7,9,14,19,24,26,31(6H)-OCTONE
CAS Number:
83721-62-4
Molecular Formula:
C56H23N3O8
Molecular Weight:
865.7971
IUPAC Name:
3,34,40-triazapentadecacyclo[34.23.0.02,18.04,17.05,14.07,12.019,35.020,33.023,32.025,30.038,58.039,55.041,54.042,51.044,49]nonapentaconta-1,4(17),5(14),7,9,11,15,18,20(33),21,23(32),25,27,29,35,38(58),39(55),41(54),42(51),44,46,48,52,56-tetracosaene-6,13,24,31,37,43,50,59-octone
InChI:
InChI=1S/C56H23N3O8/c60-49-23-7-1-4-10-26(23)52(63)37-31(49)17-13-21-22-14-18-34-40(44(22)57-43(21)37)56(67)42-41(55(34)66)47-35(29-15-19-32-38(45(29)58-47)53(64)27-11-5-2-8-24(27)50(32)61)36-30-16-20-33-39(46(30)59-48(36)42)54(65)28-12-6-3-9-25(28)51(33)62/h1-20,57-59H
InChI Key:
ZSTWGCIXDDCHFM-UHFFFAOYSA-N
SMILES:
O=C1c2ccccc2C(=O)c2c1c1[nH]c3c(c1cc2)ccc1c3C(=O)c2c(C1=O)c1[nH]c3c(c1c1c2[nH]c2c1ccc1c2C(=O)c2ccccc2C1=O)ccc1c3C(=O)c2ccccc2C1=O
EC Number:
280-589-0
Properties
Complexity:
2280
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
865.149g/mol
Formal Charge:
0
Heavy Atom Count:
67
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
865.813g/mol
Monoisotopic Mass:
865.149g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
184A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
10.1
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.