(20S)-6-chloro-20-ethyl-7-methyl-18-methylidene-10-[(4-methylpiperidin-1-yl)methyl]-20-propan-2-yloxy-17-oxa-3,13-diazapentacyclo[11.9.0.02,11.04,9.015,21]docosa-1(22),2,4(9),5,7,10,15(21)-heptaen-14-one;[(19R)-10,19-diethyl-18-methylidene-14-oxo-19-propan-2-yloxy-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,10,15(20)-heptaen-7-yl] 4-piperidin-1-ylpiperidine-1-carboxylate;(19R)-8-[(dimethylamino)methyl]-19-ethyl-7-hydroxy-19-propan-2-yloxy-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,10,15(20)-heptaene-14,18-dione;(18R)-18-ethyl-2-[(4-methylpiperazin-1-yl)methyl]-18-propan-2-yloxy-6,9,20-trioxa-13,24-diazahexacyclo[12.11.0.03,12.05,10.015,24.017,22]pentacosa-1,3,5(10),11,13,15,17(22)-heptaene-19,23-dione;(19R)-19-ethyl-19-propan-2-yloxy-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,15(20)-heptaene-14,18-dione

C150H173ClN16O23 — CID 159618461

About (20S)-6-chloro-20-ethyl-7-methyl-18-methylidene-10-[(4-methylpiperidin-1-yl)methyl]-20-propan-2-yloxy-17-oxa-3,13-diazapentacyclo[11.9.0.02,11.04,9.015,21]docosa-1(22),2,4(9),5,7,10,15(21)-heptaen-14-one;[(19R)-10,19-diethyl-18-methylidene-14-oxo-19-propan-2-yloxy-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,10,15(20)-heptaen-7-yl] 4-piperidin-1-ylpiperidine-1-carboxylate;(19R)-8-[(dimethylamino)methyl]-19-ethyl-7-hydroxy-19-propan-2-yloxy-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,10,15(20)-heptaene-14,18-dione;(18R)-18-ethyl-2-[(4-methylpiperazin-1-yl)methyl]-18-propan-2-yloxy-6,9,20-trioxa-13,24-diazahexacyclo[12.11.0.03,12.05,10.015,24.017,22]pentacosa-1,3,5(10),11,13,15,17(22)-heptaene-19,23-dione;(19R)-19-ethyl-19-propan-2-yloxy-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,15(20)-heptaene-14,18-dione

(20S)-6-chloro-20-ethyl-7-methyl-18-methylidene-10-[(4-methylpiperidin-1-yl)methyl]-20-propan-2-yloxy-17-oxa-3,13-diazapentacyclo[11.9.0.02,11.04,9.015,21]docosa-1(22),2,4(9),5,7,10,15(21)-heptaen-14-one;[(19R)-10,19-diethyl-18-methylidene-14-oxo-19-propan-2-yloxy-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,10,15(20)-heptaen-7-yl] 4-piperidin-1-ylpiperidine-1-carboxylate;(19R)-8-[(dimethylamino)methyl]-19-ethyl-7-hydroxy-19-propan-2-yloxy-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,10,15(20)-heptaene-14,18-dione;(18R)-18-ethyl-2-[(4-methylpiperazin-1-yl)methyl]-18-propan-2-yloxy-6,9,20-trioxa-13,24-diazahexacyclo[12.11.0.03,12.05,10.015,24.017,22]pentacosa-1,3,5(10),11,13,15,17(22)-heptaene-19,23-dione;(19R)-19-ethyl-19-propan-2-yloxy-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,15(20)-heptaene-14,18-dione (PubChem CID 159618461) has the molecular formula C150H173ClN16O23 and a molecular weight of 2603.58 g/mol. Its IUPAC name is (20S)-6-chloro-20-ethyl-7-methyl-18-methylidene-10-[(4-methylpiperidin-1-yl)methyl]-20-propan-2-yloxy-17-oxa-3,13-diazapentacyclo[11.9.0.02,11.04,9.015,21]docosa-1(22),2,4(9),5,7,10,15(21)-heptaen-14-one;[(19R)-10,19-diethyl-18-methylidene-14-oxo-19-propan-2-yloxy-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,10,15(20)-heptaen-7-yl] 4-piperidin-1-ylpiperidine-1-carboxylate;(19R)-8-[(dimethylamino)methyl]-19-ethyl-7-hydroxy-19-propan-2-yloxy-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,10,15(20)-heptaene-14,18-dione;(18R)-18-ethyl-2-[(4-methylpiperazin-1-yl)methyl]-18-propan-2-yloxy-6,9,20-trioxa-13,24-diazahexacyclo[12.11.0.03,12.05,10.015,24.017,22]pentacosa-1,3,5(10),11,13,15,17(22)-heptaene-19,23-dione;(19R)-19-ethyl-19-propan-2-yloxy-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,15(20)-heptaene-14,18-dione.

Molecular Properties

• Compound Name: (20S)-6-chloro-20-ethyl-7-methyl-18-methylidene-10-[(4-methylpiperidin-1-yl)methyl]-20-propan-2-yloxy-17-oxa-3,13-diazapentacyclo[11.9.0.02,11.04,9.015,21]docosa-1(22),2,4(9),5,7,10,15(21)-heptaen-14-one;[(19R)-10,19-diethyl-18-methylidene-14-oxo-19-propan-2-yloxy-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,10,15(20)-heptaen-7-yl] 4-piperidin-1-ylpiperidine-1-carboxylate;(19R)-8-[(dimethylamino)methyl]-19-ethyl-7-hydroxy-19-propan-2-yloxy-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,10,15(20)-heptaene-14,18-dione;(18R)-18-ethyl-2-[(4-methylpiperazin-1-yl)methyl]-18-propan-2-yloxy-6,9,20-trioxa-13,24-diazahexacyclo[12.11.0.03,12.05,10.015,24.017,22]pentacosa-1,3,5(10),11,13,15,17(22)-heptaene-19,23-dione;(19R)-19-ethyl-19-propan-2-yloxy-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,15(20)-heptaene-14,18-dione
• PubChem CID: 159618461
• Molecular Formula: C150H173ClN16O23
• Molecular Weight: 2603.58 g/mol
• Exact Mass: 2601.25
• IUPAC Name: (20S)-6-chloro-20-ethyl-7-methyl-18-methylidene-10-[(4-methylpiperidin-1-yl)methyl]-20-propan-2-yloxy-17-oxa-3,13-diazapentacyclo[11.9.0.02,11.04,9.015,21]docosa-1(22),2,4(9),5,7,10,15(21)-heptaen-14-one;[(19R)-10,19-diethyl-18-methylidene-14-oxo-19-propan-2-yloxy-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,10,15(20)-heptaen-7-yl] 4-piperidin-1-ylpiperidine-1-carboxylate;(19R)-8-[(dimethylamino)methyl]-19-ethyl-7-hydroxy-19-propan-2-yloxy-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,10,15(20)-heptaene-14,18-dione;(18R)-18-ethyl-2-[(4-methylpiperazin-1-yl)methyl]-18-propan-2-yloxy-6,9,20-trioxa-13,24-diazahexacyclo[12.11.0.03,12.05,10.015,24.017,22]pentacosa-1,3,5(10),11,13,15,17(22)-heptaene-19,23-dione;(19R)-19-ethyl-19-propan-2-yloxy-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,15(20)-heptaene-14,18-dione
• SMILES: C=C1C[C@](CC)(OC(C)C)c2cc3n(c(=O)c2CO1)Cc1c-3nc2cc(Cl)c(C)cc2c1CN1CCC(C)CC1.C=C1OCc2c(cc3n(c2=O)Cc2c-3nc3ccc(OC(=O)N4CCC(N5CCCCC5)CC4)cc3c2CC)[C@@]1(CC)OC(C)C.CC[C@]1(OC(C)C)C(=O)OCc2c1cc1n(c2=O)Cc2c-1nc1cc3c(cc1c2CN1CCN(C)CC1)OCCO3.CC[C@]1(OC(C)C)C(=O)OCc2c1cc1n(c2=O)Cc2cc3c(CN(C)C)c(O)ccc3nc2-1.CC[C@]1(OC(C)C)C(=O)OCc2c1cc1n(c2=O)Cc2cc3ccccc3nc2-1
• InChI: InChI=1S/C37H46N4O5.C33H40ClN3O3.C31H36N4O6.C26H29N3O5.C23H22N2O4/c1-6-27-28-19-26(45-36(43)40-17-13-25(14-18-40)39-15-9-8-10-16-39)11-12-32(28)38-34-29(27)21-41-33(34)20-31-30(35(41)42)22-44-24(5)37(31,7-2)46-23(3)4;1-7-33(40-19(2)3)15-22(6)39-18-26-27(33)13-30-31-25(17-37(30)32(26)38)24(16-36-10-8-20(4)9-11-36)23-12-21(5)28(34)14-29(23)35-31;1-5-31(41-18(2)3)23-13-25-28-21(16-35(25)29(36)22(23)17-40-30(31)37)20(15-34-8-6-33(4)7-9-34)19-12-26-27(14-24(19)32-28)39-11-10-38-26;1-6-26(34-14(2)3)19-10-21-23-15(11-29(21)24(31)18(19)13-33-25(26)32)9-16-17(12-28(4)5)22(30)8-7-20(16)27-23;1-4-23(29-13(2)3)17-10-19-20-15(9-14-7-5-6-8-18(14)24-20)11-25(19)21(26)16(17)12-28-22(23)27/h11-12,19-20,23,25H,5-10,13-18,21-22H2,1-4H3;12-14,19-20H,6-11,15-18H2,1-5H3;12-14,18H,5-11,15-17H2,1-4H3;7-10,14,30H,6,11-13H2,1-5H3;5-10,13H,4,11-12H2,1-3H3/t37-;33-;31-;26-;23-/m00111/s1
• InChIKey: MNOYJGLSVKBBDD-DRATWULNSA-N
• XLogP: 23.42
• TPSA: 402.39 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 38
• Rotatable Bonds: 24
• Heavy Atoms: 190
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2603.58
LogP ≤ 5	23.42
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	38

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'mannich_A(296)', 'substructure': 'N/A'}, {'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of (20S)-6-chloro-20-ethyl-7-methyl-18-methylidene-10-[(4-methylpiperidin-1-yl)methyl]-20-propan-2-yloxy-17-oxa-3,13-diazapentacyclo[11.9.0.02,11.04,9.015,21]docosa-1(22),2,4(9),5,7,10,15(21)-heptaen-14-one;[(19R)-10,19-diethyl-18-methylidene-14-oxo-19-propan-2-yloxy-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,10,15(20)-heptaen-7-yl] 4-piperidin-1-ylpiperidine-1-carboxylate;(19R)-8-[(dimethylamino)methyl]-19-ethyl-7-hydroxy-19-propan-2-yloxy-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,10,15(20)-heptaene-14,18-dione;(18R)-18-ethyl-2-[(4-methylpiperazin-1-yl)methyl]-18-propan-2-yloxy-6,9,20-trioxa-13,24-diazahexacyclo[12.11.0.03,12.05,10.015,24.017,22]pentacosa-1,3,5(10),11,13,15,17(22)-heptaene-19,23-dione;(19R)-19-ethyl-19-propan-2-yloxy-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,15(20)-heptaene-14,18-dione?

The IUPAC name of (20S)-6-chloro-20-ethyl-7-methyl-18-methylidene-10-[(4-methylpiperidin-1-yl)methyl]-20-propan-2-yloxy-17-oxa-3,13-diazapentacyclo[11.9.0.02,11.04,9.015,21]docosa-1(22),2,4(9),5,7,10,15(21)-heptaen-14-one;[(19R)-10,19-diethyl-18-methylidene-14-oxo-19-propan-2-yloxy-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,10,15(20)-heptaen-7-yl] 4-piperidin-1-ylpiperidine-1-carboxylate;(19R)-8-[(dimethylamino)methyl]-19-ethyl-7-hydroxy-19-propan-2-yloxy-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,10,15(20)-heptaene-14,18-dione;(18R)-18-ethyl-2-[(4-methylpiperazin-1-yl)methyl]-18-propan-2-yloxy-6,9,20-trioxa-13,24-diazahexacyclo[12.11.0.03,12.05,10.015,24.017,22]pentacosa-1,3,5(10),11,13,15,17(22)-heptaene-19,23-dione;(19R)-19-ethyl-19-propan-2-yloxy-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,15(20)-heptaene-14,18-dione (CID 159618461) is (20S)-6-chloro-20-ethyl-7-methyl-18-methylidene-10-[(4-methylpiperidin-1-yl)methyl]-20-propan-2-yloxy-17-oxa-3,13-diazapentacyclo[11.9.0.02,11.04,9.015,21]docosa-1(22),2,4(9),5,7,10,15(21)-heptaen-14-one;[(19R)-10,19-diethyl-18-methylidene-14-oxo-19-propan-2-yloxy-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,10,15(20)-heptaen-7-yl] 4-piperidin-1-ylpiperidine-1-carboxylate;(19R)-8-[(dimethylamino)methyl]-19-ethyl-7-hydroxy-19-propan-2-yloxy-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,10,15(20)-heptaene-14,18-dione;(18R)-18-ethyl-2-[(4-methylpiperazin-1-yl)methyl]-18-propan-2-yloxy-6,9,20-trioxa-13,24-diazahexacyclo[12.11.0.03,12.05,10.015,24.017,22]pentacosa-1,3,5(10),11,13,15,17(22)-heptaene-19,23-dione;(19R)-19-ethyl-19-propan-2-yloxy-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,15(20)-heptaene-14,18-dione.

What is the SMILES notation for (20S)-6-chloro-20-ethyl-7-methyl-18-methylidene-10-[(4-methylpiperidin-1-yl)methyl]-20-propan-2-yloxy-17-oxa-3,13-diazapentacyclo[11.9.0.02,11.04,9.015,21]docosa-1(22),2,4(9),5,7,10,15(21)-heptaen-14-one;[(19R)-10,19-diethyl-18-methylidene-14-oxo-19-propan-2-yloxy-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,10,15(20)-heptaen-7-yl] 4-piperidin-1-ylpiperidine-1-carboxylate;(19R)-8-[(dimethylamino)methyl]-19-ethyl-7-hydroxy-19-propan-2-yloxy-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,10,15(20)-heptaene-14,18-dione;(18R)-18-ethyl-2-[(4-methylpiperazin-1-yl)methyl]-18-propan-2-yloxy-6,9,20-trioxa-13,24-diazahexacyclo[12.11.0.03,12.05,10.015,24.017,22]pentacosa-1,3,5(10),11,13,15,17(22)-heptaene-19,23-dione;(19R)-19-ethyl-19-propan-2-yloxy-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,15(20)-heptaene-14,18-dione?

The canonical SMILES for (20S)-6-chloro-20-ethyl-7-methyl-18-methylidene-10-[(4-methylpiperidin-1-yl)methyl]-20-propan-2-yloxy-17-oxa-3,13-diazapentacyclo[11.9.0.02,11.04,9.015,21]docosa-1(22),2,4(9),5,7,10,15(21)-heptaen-14-one;[(19R)-10,19-diethyl-18-methylidene-14-oxo-19-propan-2-yloxy-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,10,15(20)-heptaen-7-yl] 4-piperidin-1-ylpiperidine-1-carboxylate;(19R)-8-[(dimethylamino)methyl]-19-ethyl-7-hydroxy-19-propan-2-yloxy-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,10,15(20)-heptaene-14,18-dione;(18R)-18-ethyl-2-[(4-methylpiperazin-1-yl)methyl]-18-propan-2-yloxy-6,9,20-trioxa-13,24-diazahexacyclo[12.11.0.03,12.05,10.015,24.017,22]pentacosa-1,3,5(10),11,13,15,17(22)-heptaene-19,23-dione;(19R)-19-ethyl-19-propan-2-yloxy-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,15(20)-heptaene-14,18-dione is C=C1C[C@](CC)(OC(C)C)c2cc3n(c(=O)c2CO1)Cc1c-3nc2cc(Cl)c(C)cc2c1CN1CCC(C)CC1.C=C1OCc2c(cc3n(c2=O)Cc2c-3nc3ccc(OC(=O)N4CCC(N5CCCCC5)CC4)cc3c2CC)[C@@]1(CC)OC(C)C.CC[C@]1(OC(C)C)C(=O)OCc2c1cc1n(c2=O)Cc2c-1nc1cc3c(cc1c2CN1CCN(C)CC1)OCCO3.CC[C@]1(OC(C)C)C(=O)OCc2c1cc1n(c2=O)Cc2cc3c(CN(C)C)c(O)ccc3nc2-1.CC[C@]1(OC(C)C)C(=O)OCc2c1cc1n(c2=O)Cc2cc3ccccc3nc2-1.

What is the InChIKey of (20S)-6-chloro-20-ethyl-7-methyl-18-methylidene-10-[(4-methylpiperidin-1-yl)methyl]-20-propan-2-yloxy-17-oxa-3,13-diazapentacyclo[11.9.0.02,11.04,9.015,21]docosa-1(22),2,4(9),5,7,10,15(21)-heptaen-14-one;[(19R)-10,19-diethyl-18-methylidene-14-oxo-19-propan-2-yloxy-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,10,15(20)-heptaen-7-yl] 4-piperidin-1-ylpiperidine-1-carboxylate;(19R)-8-[(dimethylamino)methyl]-19-ethyl-7-hydroxy-19-propan-2-yloxy-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,10,15(20)-heptaene-14,18-dione;(18R)-18-ethyl-2-[(4-methylpiperazin-1-yl)methyl]-18-propan-2-yloxy-6,9,20-trioxa-13,24-diazahexacyclo[12.11.0.03,12.05,10.015,24.017,22]pentacosa-1,3,5(10),11,13,15,17(22)-heptaene-19,23-dione;(19R)-19-ethyl-19-propan-2-yloxy-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,15(20)-heptaene-14,18-dione?

The InChIKey is MNOYJGLSVKBBDD-DRATWULNSA-N. The full InChI is InChI=1S/C37H46N4O5.C33H40ClN3O3.C31H36N4O6.C26H29N3O5.C23H22N2O4/c1-6-27-28-19-26(45-36(43)40-17-13-25(14-18-40)39-15-9-8-10-16-39)11-12-32(28)38-34-29(27)21-41-33(34)20-31-30(35(41)42)22-44-24(5)37(31,7-2)46-23(3)4;1-7-33(40-19(2)3)15-22(6)39-18-26-27(33)13-30-31-25(17-37(30)32(26)38)24(16-36-10-8-20(4)9-11-36)23-12-21(5)28(34)14-29(23)35-31;1-5-31(41-18(2)3)23-13-25-28-21(16-35(25)29(36)22(23)17-40-30(31)37)20(15-34-8-6-33(4)7-9-34)19-12-26-27(14-24(19)32-28)39-11-10-38-26;1-6-26(34-14(2)3)19-10-21-23-15(11-29(21)24(31)18(19)13-33-25(26)32)9-16-17(12-28(4)5)22(30)8-7-20(16)27-23;1-4-23(29-13(2)3)17-10-19-20-15(9-14-7-5-6-8-18(14)24-20)11-25(19)21(26)16(17)12-28-22(23)27/h11-12,19-20,23,25H,5-10,13-18,21-22H2,1-4H3;12-14,19-20H,6-11,15-18H2,1-5H3;12-14,18H,5-11,15-17H2,1-4H3;7-10,14,30H,6,11-13H2,1-5H3;5-10,13H,4,11-12H2,1-3H3/t37-;33-;31-;26-;23-/m00111/s1.

What are the key properties of (20S)-6-chloro-20-ethyl-7-methyl-18-methylidene-10-[(4-methylpiperidin-1-yl)methyl]-20-propan-2-yloxy-17-oxa-3,13-diazapentacyclo[11.9.0.02,11.04,9.015,21]docosa-1(22),2,4(9),5,7,10,15(21)-heptaen-14-one;[(19R)-10,19-diethyl-18-methylidene-14-oxo-19-propan-2-yloxy-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,10,15(20)-heptaen-7-yl] 4-piperidin-1-ylpiperidine-1-carboxylate;(19R)-8-[(dimethylamino)methyl]-19-ethyl-7-hydroxy-19-propan-2-yloxy-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,10,15(20)-heptaene-14,18-dione;(18R)-18-ethyl-2-[(4-methylpiperazin-1-yl)methyl]-18-propan-2-yloxy-6,9,20-trioxa-13,24-diazahexacyclo[12.11.0.03,12.05,10.015,24.017,22]pentacosa-1,3,5(10),11,13,15,17(22)-heptaene-19,23-dione;(19R)-19-ethyl-19-propan-2-yloxy-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,15(20)-heptaene-14,18-dione?

(20S)-6-chloro-20-ethyl-7-methyl-18-methylidene-10-[(4-methylpiperidin-1-yl)methyl]-20-propan-2-yloxy-17-oxa-3,13-diazapentacyclo[11.9.0.02,11.04,9.015,21]docosa-1(22),2,4(9),5,7,10,15(21)-heptaen-14-one;[(19R)-10,19-diethyl-18-methylidene-14-oxo-19-propan-2-yloxy-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,10,15(20)-heptaen-7-yl] 4-piperidin-1-ylpiperidine-1-carboxylate;(19R)-8-[(dimethylamino)methyl]-19-ethyl-7-hydroxy-19-propan-2-yloxy-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,10,15(20)-heptaene-14,18-dione;(18R)-18-ethyl-2-[(4-methylpiperazin-1-yl)methyl]-18-propan-2-yloxy-6,9,20-trioxa-13,24-diazahexacyclo[12.11.0.03,12.05,10.015,24.017,22]pentacosa-1,3,5(10),11,13,15,17(22)-heptaene-19,23-dione;(19R)-19-ethyl-19-propan-2-yloxy-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,15(20)-heptaene-14,18-dione has a molecular weight of 2603.58 g/mol, XLogP of 23.42, 24 rotatable bonds, 1 hydrogen bond donors, and 38 hydrogen bond acceptors.

Where does this data come from?

All data for (20S)-6-chloro-20-ethyl-7-methyl-18-methylidene-10-[(4-methylpiperidin-1-yl)methyl]-20-propan-2-yloxy-17-oxa-3,13-diazapentacyclo[11.9.0.02,11.04,9.015,21]docosa-1(22),2,4(9),5,7,10,15(21)-heptaen-14-one;[(19R)-10,19-diethyl-18-methylidene-14-oxo-19-propan-2-yloxy-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,10,15(20)-heptaen-7-yl] 4-piperidin-1-ylpiperidine-1-carboxylate;(19R)-8-[(dimethylamino)methyl]-19-ethyl-7-hydroxy-19-propan-2-yloxy-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,10,15(20)-heptaene-14,18-dione;(18R)-18-ethyl-2-[(4-methylpiperazin-1-yl)methyl]-18-propan-2-yloxy-6,9,20-trioxa-13,24-diazahexacyclo[12.11.0.03,12.05,10.015,24.017,22]pentacosa-1,3,5(10),11,13,15,17(22)-heptaene-19,23-dione;(19R)-19-ethyl-19-propan-2-yloxy-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,15(20)-heptaene-14,18-dione is sourced from PubChem (CID 159618461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).