8-chloro-6-fluoro-14-methylidene-2-propan-2-yl-10-oxa-2,13,17,18,21-pentazatetracyclo[13.5.2.04,9.018,22]docosa-1(21),4(9),5,7,15(22),16,19-heptaene;6,8-difluoro-14-methylidene-2-propan-2-yl-10-oxa-2,13,17,18,21-pentazatetracyclo[13.5.2.04,9.018,22]docosa-1(21),4(9),5,7,15(22),16,19-heptaene;6,8-difluoro-2-propan-2-yl-10-oxa-2,14,18,19,22-pentazatetracyclo[14.5.2.04,9.019,23]tricosa-1(22),4(9),5,7,16(23),17,20-heptaen-15-one;(3R)-6-fluoro-8-methoxy-3-methyl-14-methylidene-10-oxa-2,13,17,18,21-pentazatetracyclo[13.5.2.04,9.018,22]docosa-1(21),4(9),5,7,15(22),16,19-heptaene;(3R)-6-fluoro-3-methyl-14-methylidene-8-propan-2-yloxy-10-oxa-2,13,17,18,21-pentazatetracyclo[13.5.2.04,9.018,22]docosa-1(21),4(9),5,7,15(22),16,19-heptaene

C100H107ClF7N25O8 — CID 158416639

IUPAC8-chloro-6-fluoro-14-methylidene-2-propan-2-yl-10-oxa-2,13,17,18,21-pentazatetracyclo[13.5.2.04,9.018,22]docosa-1(21),4(9),5,7,15(22),16,19-heptaene;6,8-difluoro-14-methylidene-2-propan-2-yl-10-oxa-2,13,17,18,21-pentazatetracyclo[13.5.2.04,9.018,22]docosa-1(21),4(9),5,7,15(22),16,19-heptaene;6,8-difluoro-2-propan-2-yl-10-oxa-2,14,18,19,22-pentazatetracyclo[14.5.2.04,9.019,23]tricosa-1(22),4(9),5,7,16(23),17,20-heptaen-15-one;(3R)-6-fluoro-8-methoxy-3-methyl-14-methylidene-10-oxa-2,13,17,18,21-pentazatetracyclo[13.5.2.04,9.018,22]docosa-1(21),4(9),5,7,15(22),16,19-heptaene;(3R)-6-fluoro-3-methyl-14-methylidene-8-propan-2-yloxy-10-oxa-2,13,17,18,21-pentazatetracyclo[13.5.2.04,9.018,22]docosa-1(21),4(9),5,7,15(22),16,19-heptaene
SMILESC=C1NCCOc2c(Cl)cc(F)cc2CN(C(C)C)c2ccn3ncc1c3n2.C=C1NCCOc2c(F)cc(F)cc2CN(C(C)C)c2ccn3ncc1c3n2.C=C1NCCOc2c(OC(C)C)cc(F)cc2[C@@H](C)Nc2ccn3ncc1c3n2.C=C1NCCOc2c(OC)cc(F)cc2[C@@H](C)Nc2ccn3ncc1c3n2.CC(C)N1Cc2cc(F)cc(F)c2OCCCNC(=O)c2cnn3ccc1nc23
InChIInChI=1S/C21H24FN5O2.C20H21ClFN5O.C20H21F2N5O2.C20H21F2N5O.C19H20FN5O2/c1-12(2)29-18-10-15(22)9-16-14(4)25-19-5-7-27-21(26-19)17(11-24-27)13(3)23-6-8-28-20(16)18;1-12(2)26-11-14-8-15(22)9-17(21)19(14)28-7-5-23-13(3)16-10-24-27-6-4-18(26)25-20(16)27;1-12(2)26-11-13-8-14(21)9-16(22)18(13)29-7-3-5-23-20(28)15-10-24-27-6-4-17(26)25-19(15)27;1-12(2)26-11-14-8-15(21)9-17(22)19(14)28-7-5-23-13(3)16-10-24-27-6-4-18(26)25-20(16)27;1-11-15-10-22-25-6-4-17(24-19(15)25)23-12(2)14-8-13(20)9-16(26-3)18(14)27-7-5-21-11/h5,7,9-12,14,23H,3,6,8H2,1-2,4H3,(H,25,26);4,6,8-10,12,23H,3,5,7,11H2,1-2H3;4,6,8-10,12H,3,5,7,11H2,1-2H3,(H,23,28);4,6,8-10,12,23H,3,5,7,11H2,1-2H3;4,6,8-10,12,21H,1,5,7H2,2-3H3,(H,23,24)/t14-;;;;12-/m1...1/s1
InChIKeyGZZAKOPILKUDPH-YLLXAJKZSA-N
MW1955.56 g/mol
LogP16.98
Rot. Bonds6

About 8-chloro-6-fluoro-14-methylidene-2-propan-2-yl-10-oxa-2,13,17,18,21-pentazatetracyclo[13.5.2.04,9.018,22]docosa-1(21),4(9),5,7,15(22),16,19-heptaene;6,8-difluoro-14-methylidene-2-propan-2-yl-10-oxa-2,13,17,18,21-pentazatetracyclo[13.5.2.04,9.018,22]docosa-1(21),4(9),5,7,15(22),16,19-heptaene;6,8-difluoro-2-propan-2-yl-10-oxa-2,14,18,19,22-pentazatetracyclo[14.5.2.04,9.019,23]tricosa-1(22),4(9),5,7,16(23),17,20-heptaen-15-one;(3R)-6-fluoro-8-methoxy-3-methyl-14-methylidene-10-oxa-2,13,17,18,21-pentazatetracyclo[13.5.2.04,9.018,22]docosa-1(21),4(9),5,7,15(22),16,19-heptaene;(3R)-6-fluoro-3-methyl-14-methylidene-8-propan-2-yloxy-10-oxa-2,13,17,18,21-pentazatetracyclo[13.5.2.04,9.018,22]docosa-1(21),4(9),5,7,15(22),16,19-heptaene

8-chloro-6-fluoro-14-methylidene-2-propan-2-yl-10-oxa-2,13,17,18,21-pentazatetracyclo[13.5.2.04,9.018,22]docosa-1(21),4(9),5,7,15(22),16,19-heptaene;6,8-difluoro-14-methylidene-2-propan-2-yl-10-oxa-2,13,17,18,21-pentazatetracyclo[13.5.2.04,9.018,22]docosa-1(21),4(9),5,7,15(22),16,19-heptaene;6,8-difluoro-2-propan-2-yl-10-oxa-2,14,18,19,22-pentazatetracyclo[14.5.2.04,9.019,23]tricosa-1(22),4(9),5,7,16(23),17,20-heptaen-15-one;(3R)-6-fluoro-8-methoxy-3-methyl-14-methylidene-10-oxa-2,13,17,18,21-pentazatetracyclo[13.5.2.04,9.018,22]docosa-1(21),4(9),5,7,15(22),16,19-heptaene;(3R)-6-fluoro-3-methyl-14-methylidene-8-propan-2-yloxy-10-oxa-2,13,17,18,21-pentazatetracyclo[13.5.2.04,9.018,22]docosa-1(21),4(9),5,7,15(22),16,19-heptaene (PubChem CID 158416639) has the molecular formula C100H107ClF7N25O8 and a molecular weight of 1955.56 g/mol. Its IUPAC name is 8-chloro-6-fluoro-14-methylidene-2-propan-2-yl-10-oxa-2,13,17,18,21-pentazatetracyclo[13.5.2.04,9.018,22]docosa-1(21),4(9),5,7,15(22),16,19-heptaene;6,8-difluoro-14-methylidene-2-propan-2-yl-10-oxa-2,13,17,18,21-pentazatetracyclo[13.5.2.04,9.018,22]docosa-1(21),4(9),5,7,15(22),16,19-heptaene;6,8-difluoro-2-propan-2-yl-10-oxa-2,14,18,19,22-pentazatetracyclo[14.5.2.04,9.019,23]tricosa-1(22),4(9),5,7,16(23),17,20-heptaen-15-one;(3R)-6-fluoro-8-methoxy-3-methyl-14-methylidene-10-oxa-2,13,17,18,21-pentazatetracyclo[13.5.2.04,9.018,22]docosa-1(21),4(9),5,7,15(22),16,19-heptaene;(3R)-6-fluoro-3-methyl-14-methylidene-8-propan-2-yloxy-10-oxa-2,13,17,18,21-pentazatetracyclo[13.5.2.04,9.018,22]docosa-1(21),4(9),5,7,15(22),16,19-heptaene.

Molecular Properties

Compound Name8-chloro-6-fluoro-14-methylidene-2-propan-2-yl-10-oxa-2,13,17,18,21-pentazatetracyclo[13.5.2.04,9.018,22]docosa-1(21),4(9),5,7,15(22),16,19-heptaene;6,8-difluoro-14-methylidene-2-propan-2-yl-10-oxa-2,13,17,18,21-pentazatetracyclo[13.5.2.04,9.018,22]docosa-1(21),4(9),5,7,15(22),16,19-heptaene;6,8-difluoro-2-propan-2-yl-10-oxa-2,14,18,19,22-pentazatetracyclo[14.5.2.04,9.019,23]tricosa-1(22),4(9),5,7,16(23),17,20-heptaen-15-one;(3R)-6-fluoro-8-methoxy-3-methyl-14-methylidene-10-oxa-2,13,17,18,21-pentazatetracyclo[13.5.2.04,9.018,22]docosa-1(21),4(9),5,7,15(22),16,19-heptaene;(3R)-6-fluoro-3-methyl-14-methylidene-8-propan-2-yloxy-10-oxa-2,13,17,18,21-pentazatetracyclo[13.5.2.04,9.018,22]docosa-1(21),4(9),5,7,15(22),16,19-heptaene
PubChem CID158416639
Molecular FormulaC100H107ClF7N25O8
Molecular Weight1955.56 g/mol
Exact Mass1953.83
IUPAC Name8-chloro-6-fluoro-14-methylidene-2-propan-2-yl-10-oxa-2,13,17,18,21-pentazatetracyclo[13.5.2.04,9.018,22]docosa-1(21),4(9),5,7,15(22),16,19-heptaene;6,8-difluoro-14-methylidene-2-propan-2-yl-10-oxa-2,13,17,18,21-pentazatetracyclo[13.5.2.04,9.018,22]docosa-1(21),4(9),5,7,15(22),16,19-heptaene;6,8-difluoro-2-propan-2-yl-10-oxa-2,14,18,19,22-pentazatetracyclo[14.5.2.04,9.019,23]tricosa-1(22),4(9),5,7,16(23),17,20-heptaen-15-one;(3R)-6-fluoro-8-methoxy-3-methyl-14-methylidene-10-oxa-2,13,17,18,21-pentazatetracyclo[13.5.2.04,9.018,22]docosa-1(21),4(9),5,7,15(22),16,19-heptaene;(3R)-6-fluoro-3-methyl-14-methylidene-8-propan-2-yloxy-10-oxa-2,13,17,18,21-pentazatetracyclo[13.5.2.04,9.018,22]docosa-1(21),4(9),5,7,15(22),16,19-heptaene
SMILESC=C1NCCOc2c(Cl)cc(F)cc2CN(C(C)C)c2ccn3ncc1c3n2.C=C1NCCOc2c(F)cc(F)cc2CN(C(C)C)c2ccn3ncc1c3n2.C=C1NCCOc2c(OC(C)C)cc(F)cc2[C@@H](C)Nc2ccn3ncc1c3n2.C=C1NCCOc2c(OC)cc(F)cc2[C@@H](C)Nc2ccn3ncc1c3n2.CC(C)N1Cc2cc(F)cc(F)c2OCCCNC(=O)c2cnn3ccc1nc23
InChIInChI=1S/C21H24FN5O2.C20H21ClFN5O.C20H21F2N5O2.C20H21F2N5O.C19H20FN5O2/c1-12(2)29-18-10-15(22)9-16-14(4)25-19-5-7-27-21(26-19)17(11-24-27)13(3)23-6-8-28-20(16)18;1-12(2)26-11-14-8-15(22)9-17(21)19(14)28-7-5-23-13(3)16-10-24-27-6-4-18(26)25-20(16)27;1-12(2)26-11-13-8-14(21)9-16(22)18(13)29-7-3-5-23-20(28)15-10-24-27-6-4-17(26)25-19(15)27;1-12(2)26-11-14-8-15(21)9-17(22)19(14)28-7-5-23-13(3)16-10-24-27-6-4-18(26)25-20(16)27;1-11-15-10-22-25-6-4-17(24-19(15)25)23-12(2)14-8-13(20)9-16(26-3)18(14)27-7-5-21-11/h5,7,9-12,14,23H,3,6,8H2,1-2,4H3,(H,25,26);4,6,8-10,12,23H,3,5,7,11H2,1-2H3;4,6,8-10,12H,3,5,7,11H2,1-2H3,(H,23,28);4,6,8-10,12,23H,3,5,7,11H2,1-2H3;4,6,8-10,12,21H,1,5,7H2,2-3H3,(H,23,24)/t14-;;;;12-/m1...1/s1
InChIKeyGZZAKOPILKUDPH-YLLXAJKZSA-N
XLogP16.98
TPSA326.56 Ų
H-Bond Donors7
H-Bond Acceptors32
Rotatable Bonds6
Heavy Atoms141
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001955.56
LogP ≤ 516.98
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1032

Analyze 8-chloro-6-fluoro-14-methylidene-2-propan-2-yl-10-oxa-2,13,17,18,21-pentazatetracyclo[13.5.2.04,9.018,22]docosa-1(21),4(9),5,7,15(22),16,19-heptaene;6,8-difluoro-14-methylidene-2-propan-2-yl-10-oxa-2,13,17,18,21-pentazatetracyclo[13.5.2.04,9.018,22]docosa-1(21),4(9),5,7,15(22),16,19-heptaene;6,8-difluoro-2-propan-2-yl-10-oxa-2,14,18,19,22-pentazatetracyclo[14.5.2.04,9.019,23]tricosa-1(22),4(9),5,7,16(23),17,20-heptaen-15-one;(3R)-6-fluoro-8-methoxy-3-methyl-14-methylidene-10-oxa-2,13,17,18,21-pentazatetracyclo[13.5.2.04,9.018,22]docosa-1(21),4(9),5,7,15(22),16,19-heptaene;(3R)-6-fluoro-3-methyl-14-methylidene-8-propan-2-yloxy-10-oxa-2,13,17,18,21-pentazatetracyclo[13.5.2.04,9.018,22]docosa-1(21),4(9),5,7,15(22),16,19-heptaene with MolForge

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Frequently Asked Questions

What is the IUPAC name of 8-chloro-6-fluoro-14-methylidene-2-propan-2-yl-10-oxa-2,13,17,18,21-pentazatetracyclo[13.5.2.04,9.018,22]docosa-1(21),4(9),5,7,15(22),16,19-heptaene;6,8-difluoro-14-methylidene-2-propan-2-yl-10-oxa-2,13,17,18,21-pentazatetracyclo[13.5.2.04,9.018,22]docosa-1(21),4(9),5,7,15(22),16,19-heptaene;6,8-difluoro-2-propan-2-yl-10-oxa-2,14,18,19,22-pentazatetracyclo[14.5.2.04,9.019,23]tricosa-1(22),4(9),5,7,16(23),17,20-heptaen-15-one;(3R)-6-fluoro-8-methoxy-3-methyl-14-methylidene-10-oxa-2,13,17,18,21-pentazatetracyclo[13.5.2.04,9.018,22]docosa-1(21),4(9),5,7,15(22),16,19-heptaene;(3R)-6-fluoro-3-methyl-14-methylidene-8-propan-2-yloxy-10-oxa-2,13,17,18,21-pentazatetracyclo[13.5.2.04,9.018,22]docosa-1(21),4(9),5,7,15(22),16,19-heptaene?
The IUPAC name of 8-chloro-6-fluoro-14-methylidene-2-propan-2-yl-10-oxa-2,13,17,18,21-pentazatetracyclo[13.5.2.04,9.018,22]docosa-1(21),4(9),5,7,15(22),16,19-heptaene;6,8-difluoro-14-methylidene-2-propan-2-yl-10-oxa-2,13,17,18,21-pentazatetracyclo[13.5.2.04,9.018,22]docosa-1(21),4(9),5,7,15(22),16,19-heptaene;6,8-difluoro-2-propan-2-yl-10-oxa-2,14,18,19,22-pentazatetracyclo[14.5.2.04,9.019,23]tricosa-1(22),4(9),5,7,16(23),17,20-heptaen-15-one;(3R)-6-fluoro-8-methoxy-3-methyl-14-methylidene-10-oxa-2,13,17,18,21-pentazatetracyclo[13.5.2.04,9.018,22]docosa-1(21),4(9),5,7,15(22),16,19-heptaene;(3R)-6-fluoro-3-methyl-14-methylidene-8-propan-2-yloxy-10-oxa-2,13,17,18,21-pentazatetracyclo[13.5.2.04,9.018,22]docosa-1(21),4(9),5,7,15(22),16,19-heptaene (CID 158416639) is 8-chloro-6-fluoro-14-methylidene-2-propan-2-yl-10-oxa-2,13,17,18,21-pentazatetracyclo[13.5.2.04,9.018,22]docosa-1(21),4(9),5,7,15(22),16,19-heptaene;6,8-difluoro-14-methylidene-2-propan-2-yl-10-oxa-2,13,17,18,21-pentazatetracyclo[13.5.2.04,9.018,22]docosa-1(21),4(9),5,7,15(22),16,19-heptaene;6,8-difluoro-2-propan-2-yl-10-oxa-2,14,18,19,22-pentazatetracyclo[14.5.2.04,9.019,23]tricosa-1(22),4(9),5,7,16(23),17,20-heptaen-15-one;(3R)-6-fluoro-8-methoxy-3-methyl-14-methylidene-10-oxa-2,13,17,18,21-pentazatetracyclo[13.5.2.04,9.018,22]docosa-1(21),4(9),5,7,15(22),16,19-heptaene;(3R)-6-fluoro-3-methyl-14-methylidene-8-propan-2-yloxy-10-oxa-2,13,17,18,21-pentazatetracyclo[13.5.2.04,9.018,22]docosa-1(21),4(9),5,7,15(22),16,19-heptaene.
What is the SMILES notation for 8-chloro-6-fluoro-14-methylidene-2-propan-2-yl-10-oxa-2,13,17,18,21-pentazatetracyclo[13.5.2.04,9.018,22]docosa-1(21),4(9),5,7,15(22),16,19-heptaene;6,8-difluoro-14-methylidene-2-propan-2-yl-10-oxa-2,13,17,18,21-pentazatetracyclo[13.5.2.04,9.018,22]docosa-1(21),4(9),5,7,15(22),16,19-heptaene;6,8-difluoro-2-propan-2-yl-10-oxa-2,14,18,19,22-pentazatetracyclo[14.5.2.04,9.019,23]tricosa-1(22),4(9),5,7,16(23),17,20-heptaen-15-one;(3R)-6-fluoro-8-methoxy-3-methyl-14-methylidene-10-oxa-2,13,17,18,21-pentazatetracyclo[13.5.2.04,9.018,22]docosa-1(21),4(9),5,7,15(22),16,19-heptaene;(3R)-6-fluoro-3-methyl-14-methylidene-8-propan-2-yloxy-10-oxa-2,13,17,18,21-pentazatetracyclo[13.5.2.04,9.018,22]docosa-1(21),4(9),5,7,15(22),16,19-heptaene?
The canonical SMILES for 8-chloro-6-fluoro-14-methylidene-2-propan-2-yl-10-oxa-2,13,17,18,21-pentazatetracyclo[13.5.2.04,9.018,22]docosa-1(21),4(9),5,7,15(22),16,19-heptaene;6,8-difluoro-14-methylidene-2-propan-2-yl-10-oxa-2,13,17,18,21-pentazatetracyclo[13.5.2.04,9.018,22]docosa-1(21),4(9),5,7,15(22),16,19-heptaene;6,8-difluoro-2-propan-2-yl-10-oxa-2,14,18,19,22-pentazatetracyclo[14.5.2.04,9.019,23]tricosa-1(22),4(9),5,7,16(23),17,20-heptaen-15-one;(3R)-6-fluoro-8-methoxy-3-methyl-14-methylidene-10-oxa-2,13,17,18,21-pentazatetracyclo[13.5.2.04,9.018,22]docosa-1(21),4(9),5,7,15(22),16,19-heptaene;(3R)-6-fluoro-3-methyl-14-methylidene-8-propan-2-yloxy-10-oxa-2,13,17,18,21-pentazatetracyclo[13.5.2.04,9.018,22]docosa-1(21),4(9),5,7,15(22),16,19-heptaene is C=C1NCCOc2c(Cl)cc(F)cc2CN(C(C)C)c2ccn3ncc1c3n2.C=C1NCCOc2c(F)cc(F)cc2CN(C(C)C)c2ccn3ncc1c3n2.C=C1NCCOc2c(OC(C)C)cc(F)cc2[C@@H](C)Nc2ccn3ncc1c3n2.C=C1NCCOc2c(OC)cc(F)cc2[C@@H](C)Nc2ccn3ncc1c3n2.CC(C)N1Cc2cc(F)cc(F)c2OCCCNC(=O)c2cnn3ccc1nc23.
What is the InChIKey of 8-chloro-6-fluoro-14-methylidene-2-propan-2-yl-10-oxa-2,13,17,18,21-pentazatetracyclo[13.5.2.04,9.018,22]docosa-1(21),4(9),5,7,15(22),16,19-heptaene;6,8-difluoro-14-methylidene-2-propan-2-yl-10-oxa-2,13,17,18,21-pentazatetracyclo[13.5.2.04,9.018,22]docosa-1(21),4(9),5,7,15(22),16,19-heptaene;6,8-difluoro-2-propan-2-yl-10-oxa-2,14,18,19,22-pentazatetracyclo[14.5.2.04,9.019,23]tricosa-1(22),4(9),5,7,16(23),17,20-heptaen-15-one;(3R)-6-fluoro-8-methoxy-3-methyl-14-methylidene-10-oxa-2,13,17,18,21-pentazatetracyclo[13.5.2.04,9.018,22]docosa-1(21),4(9),5,7,15(22),16,19-heptaene;(3R)-6-fluoro-3-methyl-14-methylidene-8-propan-2-yloxy-10-oxa-2,13,17,18,21-pentazatetracyclo[13.5.2.04,9.018,22]docosa-1(21),4(9),5,7,15(22),16,19-heptaene?
The InChIKey is GZZAKOPILKUDPH-YLLXAJKZSA-N. The full InChI is InChI=1S/C21H24FN5O2.C20H21ClFN5O.C20H21F2N5O2.C20H21F2N5O.C19H20FN5O2/c1-12(2)29-18-10-15(22)9-16-14(4)25-19-5-7-27-21(26-19)17(11-24-27)13(3)23-6-8-28-20(16)18;1-12(2)26-11-14-8-15(22)9-17(21)19(14)28-7-5-23-13(3)16-10-24-27-6-4-18(26)25-20(16)27;1-12(2)26-11-13-8-14(21)9-16(22)18(13)29-7-3-5-23-20(28)15-10-24-27-6-4-17(26)25-19(15)27;1-12(2)26-11-14-8-15(21)9-17(22)19(14)28-7-5-23-13(3)16-10-24-27-6-4-18(26)25-20(16)27;1-11-15-10-22-25-6-4-17(24-19(15)25)23-12(2)14-8-13(20)9-16(26-3)18(14)27-7-5-21-11/h5,7,9-12,14,23H,3,6,8H2,1-2,4H3,(H,25,26);4,6,8-10,12,23H,3,5,7,11H2,1-2H3;4,6,8-10,12H,3,5,7,11H2,1-2H3,(H,23,28);4,6,8-10,12,23H,3,5,7,11H2,1-2H3;4,6,8-10,12,21H,1,5,7H2,2-3H3,(H,23,24)/t14-;;;;12-/m1...1/s1.
What are the key properties of 8-chloro-6-fluoro-14-methylidene-2-propan-2-yl-10-oxa-2,13,17,18,21-pentazatetracyclo[13.5.2.04,9.018,22]docosa-1(21),4(9),5,7,15(22),16,19-heptaene;6,8-difluoro-14-methylidene-2-propan-2-yl-10-oxa-2,13,17,18,21-pentazatetracyclo[13.5.2.04,9.018,22]docosa-1(21),4(9),5,7,15(22),16,19-heptaene;6,8-difluoro-2-propan-2-yl-10-oxa-2,14,18,19,22-pentazatetracyclo[14.5.2.04,9.019,23]tricosa-1(22),4(9),5,7,16(23),17,20-heptaen-15-one;(3R)-6-fluoro-8-methoxy-3-methyl-14-methylidene-10-oxa-2,13,17,18,21-pentazatetracyclo[13.5.2.04,9.018,22]docosa-1(21),4(9),5,7,15(22),16,19-heptaene;(3R)-6-fluoro-3-methyl-14-methylidene-8-propan-2-yloxy-10-oxa-2,13,17,18,21-pentazatetracyclo[13.5.2.04,9.018,22]docosa-1(21),4(9),5,7,15(22),16,19-heptaene?
8-chloro-6-fluoro-14-methylidene-2-propan-2-yl-10-oxa-2,13,17,18,21-pentazatetracyclo[13.5.2.04,9.018,22]docosa-1(21),4(9),5,7,15(22),16,19-heptaene;6,8-difluoro-14-methylidene-2-propan-2-yl-10-oxa-2,13,17,18,21-pentazatetracyclo[13.5.2.04,9.018,22]docosa-1(21),4(9),5,7,15(22),16,19-heptaene;6,8-difluoro-2-propan-2-yl-10-oxa-2,14,18,19,22-pentazatetracyclo[14.5.2.04,9.019,23]tricosa-1(22),4(9),5,7,16(23),17,20-heptaen-15-one;(3R)-6-fluoro-8-methoxy-3-methyl-14-methylidene-10-oxa-2,13,17,18,21-pentazatetracyclo[13.5.2.04,9.018,22]docosa-1(21),4(9),5,7,15(22),16,19-heptaene;(3R)-6-fluoro-3-methyl-14-methylidene-8-propan-2-yloxy-10-oxa-2,13,17,18,21-pentazatetracyclo[13.5.2.04,9.018,22]docosa-1(21),4(9),5,7,15(22),16,19-heptaene has a molecular weight of 1955.56 g/mol, XLogP of 16.98, 6 rotatable bonds, 7 hydrogen bond donors, and 32 hydrogen bond acceptors.
Where does this data come from?
All data for 8-chloro-6-fluoro-14-methylidene-2-propan-2-yl-10-oxa-2,13,17,18,21-pentazatetracyclo[13.5.2.04,9.018,22]docosa-1(21),4(9),5,7,15(22),16,19-heptaene;6,8-difluoro-14-methylidene-2-propan-2-yl-10-oxa-2,13,17,18,21-pentazatetracyclo[13.5.2.04,9.018,22]docosa-1(21),4(9),5,7,15(22),16,19-heptaene;6,8-difluoro-2-propan-2-yl-10-oxa-2,14,18,19,22-pentazatetracyclo[14.5.2.04,9.019,23]tricosa-1(22),4(9),5,7,16(23),17,20-heptaen-15-one;(3R)-6-fluoro-8-methoxy-3-methyl-14-methylidene-10-oxa-2,13,17,18,21-pentazatetracyclo[13.5.2.04,9.018,22]docosa-1(21),4(9),5,7,15(22),16,19-heptaene;(3R)-6-fluoro-3-methyl-14-methylidene-8-propan-2-yloxy-10-oxa-2,13,17,18,21-pentazatetracyclo[13.5.2.04,9.018,22]docosa-1(21),4(9),5,7,15(22),16,19-heptaene is sourced from PubChem (CID 158416639), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).