AGN-PC-0JKOPO

1-[7-(4-fluorophenyl)-17,20-dihydroxy-2,11,16,18-tetramethyl-6,7-diazapentacyclo[11.7.0.02,10.04,8.014,18]icosa-4(8),5,9,11-tetraen-17-yl]-2-hydroxyethanone

CAS: 31738-10-0

Molecular Formula	`C30H35FN2O4`
Molecular Weight	506.6 g/mol
LogP	4.0
Topological Polar Surface Area	95.6 A2
Hydrogen Bond Donors	3
Hydrogen Bond Acceptors	6
Rotatable Bonds	3
Exact Mass	506.2581
Heavy Atoms	37
Complexity	1020.0

Chemical Identifiers

CAS Number	31738-10-0
SMILES	`CC1CC2C3C=C(C4=CC5=C(CC4(C3C(CC2(C1(C(=O)CO)O)C)O)C)C=NN5C6=CC=C(C=C6)F)C`
InChIKey	`HMIRYTLYTWFOPG-UHFFFAOYSA-N`

📖 Product Overview

AGN-PC-0JKOPO (CAS: 31738-10-0) is a chemical compound with molecular formula C30H35FN2O4 and molecular weight 506.6 g/mol. Its IUPAC systematic name is 1-[7-(4-fluorophenyl)-17,20-dihydroxy-2,11,16,18-tetramethyl-6,7-diazapentacyclo[11.7.0.02,10.04,8.014,18]icosa-4(8),5,9,11-tetraen-17-yl]-2-hydroxyethanone. LogP 4.0 Topological Polar Surface Area 95.6 A2 Hydrogen Bond Donors 3 Hydrogen Bond Acceptors 6 Rotatable Bonds 3 Exact Mass 506.2581 Heavy Atoms 37 Complexity 1020.0 InChI Key: HMIRYTLYTWFOPG-UHFFFAOYSA-N. SMILES: CC1CC2C3C=C(C4=CC5=C(CC4(C3C(CC2(C1(C(=O)CO)O)C)O)C)C=NN5C6=CC=C(C=C6)F)C.

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