4-ethyl-10-propan-2-yl-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene;4-isocyano-10-propan-2-yl-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene;4-(oxetan-3-yloxy)-10-propan-2-yl-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene;4-(oxolan-3-yloxy)-10-propan-2-yl-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene;6-propan-2-yl-8-oxa-12λ6-thia-1,3-diazatricyclo[8.4.0.02,7]tetradeca-2,4,6-triene 12,12-dioxide;10-propan-2-yl-4-propoxy-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene;10-propan-2-yl-4-pyrazol-1-yl-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene

C107H147N17O14S — CID 161373866

IUPAC4-ethyl-10-propan-2-yl-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene;4-isocyano-10-propan-2-yl-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene;4-(oxetan-3-yloxy)-10-propan-2-yl-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene;4-(oxolan-3-yloxy)-10-propan-2-yl-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene;6-propan-2-yl-8-oxa-12λ6-thia-1,3-diazatricyclo[8.4.0.02,7]tetradeca-2,4,6-triene 12,12-dioxide;10-propan-2-yl-4-propoxy-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene;10-propan-2-yl-4-pyrazol-1-yl-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene
SMILESCC(C)c1ccnc2c1OCC1CC(OC3CCOC3)CN21.CC(C)c1ccnc2c1OCC1CC(OC3COC3)CN21.CC(C)c1ccnc2c1OCC1CC(n3cccn3)CN21.CC(C)c1ccnc2c1OCC1CS(=O)(=O)CCN21.CCC1CC2COc3c(C(C)C)ccnc3N2C1.CCCOC1CC2COc3c(C(C)C)ccnc3N2C1.[C-]#[N+]C1CC2COc3c(C(C)C)ccnc3N2C1
InChIInChI=1S/C17H24N2O3.C16H20N4O.C16H22N2O3.C16H24N2O2.C15H22N2O.C14H17N3O.C13H18N2O3S/c1-11(2)15-3-5-18-17-16(15)21-9-12-7-14(8-19(12)17)22-13-4-6-20-10-13;1-11(2)14-4-6-17-16-15(14)21-10-13-8-12(9-19(13)16)20-7-3-5-18-20;1-10(2)14-3-4-17-16-15(14)20-7-11-5-12(6-18(11)16)21-13-8-19-9-13;1-4-7-19-13-8-12-10-20-15-14(11(2)3)5-6-17-16(15)18(12)9-13;1-4-11-7-12-9-18-14-13(10(2)3)5-6-16-15(14)17(12)8-11;1-9(2)12-4-5-16-14-13(12)18-8-11-6-10(15-3)7-17(11)14;1-9(2)11-3-4-14-13-12(11)18-7-10-8-19(16,17)6-5-15(10)13/h3,5,11-14H,4,6-10H2,1-2H3;3-7,11-13H,8-10H2,1-2H3;3-4,10-13H,5-9H2,1-2H3;5-6,11-13H,4,7-10H2,1-3H3;5-6,10-12H,4,7-9H2,1-3H3;4-5,9-11H,6-8H2,1-2H3;3-4,9-10H,5-8H2,1-2H3
InChIKeyVQVARWCDBAYHGW-UHFFFAOYSA-N
MW1927.52 g/mol
LogP16.76
Rot. Bonds16

About 4-ethyl-10-propan-2-yl-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene;4-isocyano-10-propan-2-yl-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene;4-(oxetan-3-yloxy)-10-propan-2-yl-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene;4-(oxolan-3-yloxy)-10-propan-2-yl-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene;6-propan-2-yl-8-oxa-12λ6-thia-1,3-diazatricyclo[8.4.0.02,7]tetradeca-2,4,6-triene 12,12-dioxide;10-propan-2-yl-4-propoxy-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene;10-propan-2-yl-4-pyrazol-1-yl-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene

4-ethyl-10-propan-2-yl-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene;4-isocyano-10-propan-2-yl-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene;4-(oxetan-3-yloxy)-10-propan-2-yl-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene;4-(oxolan-3-yloxy)-10-propan-2-yl-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene;6-propan-2-yl-8-oxa-12λ6-thia-1,3-diazatricyclo[8.4.0.02,7]tetradeca-2,4,6-triene 12,12-dioxide;10-propan-2-yl-4-propoxy-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene;10-propan-2-yl-4-pyrazol-1-yl-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene (PubChem CID 161373866) has the molecular formula C107H147N17O14S and a molecular weight of 1927.52 g/mol. Its IUPAC name is 4-ethyl-10-propan-2-yl-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene;4-isocyano-10-propan-2-yl-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene;4-(oxetan-3-yloxy)-10-propan-2-yl-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene;4-(oxolan-3-yloxy)-10-propan-2-yl-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene;6-propan-2-yl-8-oxa-12λ6-thia-1,3-diazatricyclo[8.4.0.02,7]tetradeca-2,4,6-triene 12,12-dioxide;10-propan-2-yl-4-propoxy-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene;10-propan-2-yl-4-pyrazol-1-yl-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene.

Molecular Properties

Compound Name4-ethyl-10-propan-2-yl-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene;4-isocyano-10-propan-2-yl-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene;4-(oxetan-3-yloxy)-10-propan-2-yl-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene;4-(oxolan-3-yloxy)-10-propan-2-yl-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene;6-propan-2-yl-8-oxa-12λ6-thia-1,3-diazatricyclo[8.4.0.02,7]tetradeca-2,4,6-triene 12,12-dioxide;10-propan-2-yl-4-propoxy-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene;10-propan-2-yl-4-pyrazol-1-yl-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene
PubChem CID161373866
Molecular FormulaC107H147N17O14S
Molecular Weight1927.52 g/mol
Exact Mass1926.10
IUPAC Name4-ethyl-10-propan-2-yl-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene;4-isocyano-10-propan-2-yl-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene;4-(oxetan-3-yloxy)-10-propan-2-yl-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene;4-(oxolan-3-yloxy)-10-propan-2-yl-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene;6-propan-2-yl-8-oxa-12λ6-thia-1,3-diazatricyclo[8.4.0.02,7]tetradeca-2,4,6-triene 12,12-dioxide;10-propan-2-yl-4-propoxy-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene;10-propan-2-yl-4-pyrazol-1-yl-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene
SMILESCC(C)c1ccnc2c1OCC1CC(OC3CCOC3)CN21.CC(C)c1ccnc2c1OCC1CC(OC3COC3)CN21.CC(C)c1ccnc2c1OCC1CC(n3cccn3)CN21.CC(C)c1ccnc2c1OCC1CS(=O)(=O)CCN21.CCC1CC2COc3c(C(C)C)ccnc3N2C1.CCCOC1CC2COc3c(C(C)C)ccnc3N2C1.[C-]#[N+]C1CC2COc3c(C(C)C)ccnc3N2C1
InChIInChI=1S/C17H24N2O3.C16H20N4O.C16H22N2O3.C16H24N2O2.C15H22N2O.C14H17N3O.C13H18N2O3S/c1-11(2)15-3-5-18-17-16(15)21-9-12-7-14(8-19(12)17)22-13-4-6-20-10-13;1-11(2)14-4-6-17-16-15(14)21-10-13-8-12(9-19(13)16)20-7-3-5-18-20;1-10(2)14-3-4-17-16-15(14)20-7-11-5-12(6-18(11)16)21-13-8-19-9-13;1-4-7-19-13-8-12-10-20-15-14(11(2)3)5-6-17-16(15)18(12)9-13;1-4-11-7-12-9-18-14-13(10(2)3)5-6-16-15(14)17(12)8-11;1-9(2)12-4-5-16-14-13(12)18-8-11-6-10(15-3)7-17(11)14;1-9(2)11-3-4-14-13-12(11)18-7-10-8-19(16,17)6-5-15(10)13/h3,5,11-14H,4,6-10H2,1-2H3;3-7,11-13H,8-10H2,1-2H3;3-4,10-13H,5-9H2,1-2H3;5-6,11-13H,4,7-10H2,1-3H3;5-6,10-12H,4,7-9H2,1-3H3;4-5,9-11H,6-8H2,1-2H3;3-4,9-10H,5-8H2,1-2H3
InChIKeyVQVARWCDBAYHGW-UHFFFAOYSA-N
XLogP16.76
TPSA279.99 Ų
H-Bond Donors
H-Bond Acceptors30
Rotatable Bonds16
Heavy Atoms139
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001927.52
LogP ≤ 516.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1030

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

Analyze 4-ethyl-10-propan-2-yl-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene;4-isocyano-10-propan-2-yl-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene;4-(oxetan-3-yloxy)-10-propan-2-yl-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene;4-(oxolan-3-yloxy)-10-propan-2-yl-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene;6-propan-2-yl-8-oxa-12λ6-thia-1,3-diazatricyclo[8.4.0.02,7]tetradeca-2,4,6-triene 12,12-dioxide;10-propan-2-yl-4-propoxy-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene;10-propan-2-yl-4-pyrazol-1-yl-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene with MolForge

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Related Compounds

4-(2-methoxyethoxy)-10-propan-2-yl-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene
CID 146510472
(4R)-4-fluoro-10-propan-2-yl-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene
CID 146510454
10-propan-2-yl-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene
CID 146477407
[3-[(4S)-4-amino-2-oxa-8-azaspiro[4.5]decan-8-yl]-6-[[(4S,6S)-4-(oxolan-3-yloxy)-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-trien-10-yl]sulfanyl]pyrazin-2-yl]methanol
CID 166881307
(4S,6S)-10-iodo-4-(methoxymethyl)-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene
CID 146448260
[3-[(3S,4S)-4-amino-3-methyl-2-oxa-8-azaspiro[4.5]decan-8-yl]-6-[[(4S,6S)-4-propoxy-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-trien-10-yl]sulfanyl]pyrazin-2-yl]methanol
CID 159833189
3-pyrazol-1-ylthiolane 1,1-dioxide
CID 43531677
4-(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)-6-propoxypyrimidin-5-amine
CID 102882523
1-[1-(oxan-4-ylmethyl)pyrrolidin-3-yl]pyrazole
CID 126946622
4-[2-(3-pyrazol-1-ylpyrrolidin-1-yl)ethyl]morpholine
CID 126946440
2-[(3S,4S)-4-amino-3-methyl-2-oxa-8-azaspiro[4.5]decan-8-yl]-5-[[(6S)-4-(methoxymethyl)-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-trien-10-yl]sulfanyl]-3-methylpyrimidin-4-one
CID 146510873
[4-(oxan-4-yloxy)phenyl]-(3-pyrazol-1-ylpyrrolidin-1-yl)methanone
CID 136543985

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-10-propan-2-yl-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene;4-isocyano-10-propan-2-yl-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene;4-(oxetan-3-yloxy)-10-propan-2-yl-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene;4-(oxolan-3-yloxy)-10-propan-2-yl-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene;6-propan-2-yl-8-oxa-12λ6-thia-1,3-diazatricyclo[8.4.0.02,7]tetradeca-2,4,6-triene 12,12-dioxide;10-propan-2-yl-4-propoxy-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene;10-propan-2-yl-4-pyrazol-1-yl-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene?
The IUPAC name of 4-ethyl-10-propan-2-yl-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene;4-isocyano-10-propan-2-yl-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene;4-(oxetan-3-yloxy)-10-propan-2-yl-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene;4-(oxolan-3-yloxy)-10-propan-2-yl-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene;6-propan-2-yl-8-oxa-12λ6-thia-1,3-diazatricyclo[8.4.0.02,7]tetradeca-2,4,6-triene 12,12-dioxide;10-propan-2-yl-4-propoxy-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene;10-propan-2-yl-4-pyrazol-1-yl-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene (CID 161373866) is 4-ethyl-10-propan-2-yl-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene;4-isocyano-10-propan-2-yl-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene;4-(oxetan-3-yloxy)-10-propan-2-yl-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene;4-(oxolan-3-yloxy)-10-propan-2-yl-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene;6-propan-2-yl-8-oxa-12λ6-thia-1,3-diazatricyclo[8.4.0.02,7]tetradeca-2,4,6-triene 12,12-dioxide;10-propan-2-yl-4-propoxy-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene;10-propan-2-yl-4-pyrazol-1-yl-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene.
What is the SMILES notation for 4-ethyl-10-propan-2-yl-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene;4-isocyano-10-propan-2-yl-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene;4-(oxetan-3-yloxy)-10-propan-2-yl-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene;4-(oxolan-3-yloxy)-10-propan-2-yl-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene;6-propan-2-yl-8-oxa-12λ6-thia-1,3-diazatricyclo[8.4.0.02,7]tetradeca-2,4,6-triene 12,12-dioxide;10-propan-2-yl-4-propoxy-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene;10-propan-2-yl-4-pyrazol-1-yl-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene?
The canonical SMILES for 4-ethyl-10-propan-2-yl-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene;4-isocyano-10-propan-2-yl-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene;4-(oxetan-3-yloxy)-10-propan-2-yl-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene;4-(oxolan-3-yloxy)-10-propan-2-yl-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene;6-propan-2-yl-8-oxa-12λ6-thia-1,3-diazatricyclo[8.4.0.02,7]tetradeca-2,4,6-triene 12,12-dioxide;10-propan-2-yl-4-propoxy-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene;10-propan-2-yl-4-pyrazol-1-yl-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene is CC(C)c1ccnc2c1OCC1CC(OC3CCOC3)CN21.CC(C)c1ccnc2c1OCC1CC(OC3COC3)CN21.CC(C)c1ccnc2c1OCC1CC(n3cccn3)CN21.CC(C)c1ccnc2c1OCC1CS(=O)(=O)CCN21.CCC1CC2COc3c(C(C)C)ccnc3N2C1.CCCOC1CC2COc3c(C(C)C)ccnc3N2C1.[C-]#[N+]C1CC2COc3c(C(C)C)ccnc3N2C1.
What is the InChIKey of 4-ethyl-10-propan-2-yl-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene;4-isocyano-10-propan-2-yl-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene;4-(oxetan-3-yloxy)-10-propan-2-yl-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene;4-(oxolan-3-yloxy)-10-propan-2-yl-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene;6-propan-2-yl-8-oxa-12λ6-thia-1,3-diazatricyclo[8.4.0.02,7]tetradeca-2,4,6-triene 12,12-dioxide;10-propan-2-yl-4-propoxy-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene;10-propan-2-yl-4-pyrazol-1-yl-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene?
The InChIKey is VQVARWCDBAYHGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O3.C16H20N4O.C16H22N2O3.C16H24N2O2.C15H22N2O.C14H17N3O.C13H18N2O3S/c1-11(2)15-3-5-18-17-16(15)21-9-12-7-14(8-19(12)17)22-13-4-6-20-10-13;1-11(2)14-4-6-17-16-15(14)21-10-13-8-12(9-19(13)16)20-7-3-5-18-20;1-10(2)14-3-4-17-16-15(14)20-7-11-5-12(6-18(11)16)21-13-8-19-9-13;1-4-7-19-13-8-12-10-20-15-14(11(2)3)5-6-17-16(15)18(12)9-13;1-4-11-7-12-9-18-14-13(10(2)3)5-6-16-15(14)17(12)8-11;1-9(2)12-4-5-16-14-13(12)18-8-11-6-10(15-3)7-17(11)14;1-9(2)11-3-4-14-13-12(11)18-7-10-8-19(16,17)6-5-15(10)13/h3,5,11-14H,4,6-10H2,1-2H3;3-7,11-13H,8-10H2,1-2H3;3-4,10-13H,5-9H2,1-2H3;5-6,11-13H,4,7-10H2,1-3H3;5-6,10-12H,4,7-9H2,1-3H3;4-5,9-11H,6-8H2,1-2H3;3-4,9-10H,5-8H2,1-2H3.
What are the key properties of 4-ethyl-10-propan-2-yl-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene;4-isocyano-10-propan-2-yl-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene;4-(oxetan-3-yloxy)-10-propan-2-yl-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene;4-(oxolan-3-yloxy)-10-propan-2-yl-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene;6-propan-2-yl-8-oxa-12λ6-thia-1,3-diazatricyclo[8.4.0.02,7]tetradeca-2,4,6-triene 12,12-dioxide;10-propan-2-yl-4-propoxy-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene;10-propan-2-yl-4-pyrazol-1-yl-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene?
4-ethyl-10-propan-2-yl-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene;4-isocyano-10-propan-2-yl-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene;4-(oxetan-3-yloxy)-10-propan-2-yl-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene;4-(oxolan-3-yloxy)-10-propan-2-yl-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene;6-propan-2-yl-8-oxa-12λ6-thia-1,3-diazatricyclo[8.4.0.02,7]tetradeca-2,4,6-triene 12,12-dioxide;10-propan-2-yl-4-propoxy-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene;10-propan-2-yl-4-pyrazol-1-yl-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene has a molecular weight of 1927.52 g/mol, XLogP of 16.76, 16 rotatable bonds, 0 hydrogen bond donors, and 30 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-10-propan-2-yl-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene;4-isocyano-10-propan-2-yl-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene;4-(oxetan-3-yloxy)-10-propan-2-yl-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene;4-(oxolan-3-yloxy)-10-propan-2-yl-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene;6-propan-2-yl-8-oxa-12λ6-thia-1,3-diazatricyclo[8.4.0.02,7]tetradeca-2,4,6-triene 12,12-dioxide;10-propan-2-yl-4-propoxy-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene;10-propan-2-yl-4-pyrazol-1-yl-8-oxa-2,13-diazatricyclo[7.4.0.02,6]trideca-1(13),9,11-triene is sourced from PubChem (CID 161373866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).