1-[5-(cyclobuten-1-yl)-2,3-dihydro-1H-inden-4-yl]-3-(3-oxa-8-azatricyclo[6.2.2.02,6]dodeca-2(6),4-dien-4-ylsulfonyl)urea;1-[(3-cyclopropyl-3,4,8-triazatricyclo[6.2.2.02,6]dodeca-2(6),4-dien-5-yl)sulfonyl]-3-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)propan-2-one;1-[(3-cyclopropyl-3,4,8-triazatricyclo[6.2.2.02,6]dodeca-2(6),4-dien-5-yl)sulfonyl]-3-[5-(2-methoxy-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]propan-2-one;1-[2-(2-methoxy-4-pyridinyl)-5,6-dihydro-4H-cyclopenta[b]thiophen-3-yl]-3-(3-thia-8-azatricyclo[6.2.2.02,6]dodeca-2(6),4-dien-4-ylsulfonyl)urea;1-[2-(2-methoxy-4-pyridinyl)-5,6-dihydro-4H-cyclopenta[b]thiophen-3-yl]-3-(2,3,8-triazatricyclo[6.2.2.02,6]dodeca-3,5-dien-4-ylsulfonyl)urea;1-(3-oxa-8-azatricyclo[6.2.2.02,6]dodeca-2(6),4-dien-4-ylsulfonyl)-3-(5-prop-1-ynyl-2,3-dihydro-1H-inden-4-yl)urea

C151H171N23O23S9 — CID 161307976

About 1-[5-(cyclobuten-1-yl)-2,3-dihydro-1H-inden-4-yl]-3-(3-oxa-8-azatricyclo[6.2.2.02,6]dodeca-2(6),4-dien-4-ylsulfonyl)urea;1-[(3-cyclopropyl-3,4,8-triazatricyclo[6.2.2.02,6]dodeca-2(6),4-dien-5-yl)sulfonyl]-3-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)propan-2-one;1-[(3-cyclopropyl-3,4,8-triazatricyclo[6.2.2.02,6]dodeca-2(6),4-dien-5-yl)sulfonyl]-3-[5-(2-methoxy-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]propan-2-one;1-[2-(2-methoxy-4-pyridinyl)-5,6-dihydro-4H-cyclopenta[b]thiophen-3-yl]-3-(3-thia-8-azatricyclo[6.2.2.02,6]dodeca-2(6),4-dien-4-ylsulfonyl)urea;1-[2-(2-methoxy-4-pyridinyl)-5,6-dihydro-4H-cyclopenta[b]thiophen-3-yl]-3-(2,3,8-triazatricyclo[6.2.2.02,6]dodeca-3,5-dien-4-ylsulfonyl)urea;1-(3-oxa-8-azatricyclo[6.2.2.02,6]dodeca-2(6),4-dien-4-ylsulfonyl)-3-(5-prop-1-ynyl-2,3-dihydro-1H-inden-4-yl)urea

1-[5-(cyclobuten-1-yl)-2,3-dihydro-1H-inden-4-yl]-3-(3-oxa-8-azatricyclo[6.2.2.02,6]dodeca-2(6),4-dien-4-ylsulfonyl)urea;1-[(3-cyclopropyl-3,4,8-triazatricyclo[6.2.2.02,6]dodeca-2(6),4-dien-5-yl)sulfonyl]-3-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)propan-2-one;1-[(3-cyclopropyl-3,4,8-triazatricyclo[6.2.2.02,6]dodeca-2(6),4-dien-5-yl)sulfonyl]-3-[5-(2-methoxy-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]propan-2-one;1-[2-(2-methoxy-4-pyridinyl)-5,6-dihydro-4H-cyclopenta[b]thiophen-3-yl]-3-(3-thia-8-azatricyclo[6.2.2.02,6]dodeca-2(6),4-dien-4-ylsulfonyl)urea;1-[2-(2-methoxy-4-pyridinyl)-5,6-dihydro-4H-cyclopenta[b]thiophen-3-yl]-3-(2,3,8-triazatricyclo[6.2.2.02,6]dodeca-3,5-dien-4-ylsulfonyl)urea;1-(3-oxa-8-azatricyclo[6.2.2.02,6]dodeca-2(6),4-dien-4-ylsulfonyl)-3-(5-prop-1-ynyl-2,3-dihydro-1H-inden-4-yl)urea (PubChem CID 161307976) has the molecular formula C151H171N23O23S9 and a molecular weight of 2964.77 g/mol. Its IUPAC name is 1-[5-(cyclobuten-1-yl)-2,3-dihydro-1H-inden-4-yl]-3-(3-oxa-8-azatricyclo[6.2.2.02,6]dodeca-2(6),4-dien-4-ylsulfonyl)urea;1-[(3-cyclopropyl-3,4,8-triazatricyclo[6.2.2.02,6]dodeca-2(6),4-dien-5-yl)sulfonyl]-3-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)propan-2-one;1-[(3-cyclopropyl-3,4,8-triazatricyclo[6.2.2.02,6]dodeca-2(6),4-dien-5-yl)sulfonyl]-3-[5-(2-methoxy-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]propan-2-one;1-[2-(2-methoxy-4-pyridinyl)-5,6-dihydro-4H-cyclopenta[b]thiophen-3-yl]-3-(3-thia-8-azatricyclo[6.2.2.02,6]dodeca-2(6),4-dien-4-ylsulfonyl)urea;1-[2-(2-methoxy-4-pyridinyl)-5,6-dihydro-4H-cyclopenta[b]thiophen-3-yl]-3-(2,3,8-triazatricyclo[6.2.2.02,6]dodeca-3,5-dien-4-ylsulfonyl)urea;1-(3-oxa-8-azatricyclo[6.2.2.02,6]dodeca-2(6),4-dien-4-ylsulfonyl)-3-(5-prop-1-ynyl-2,3-dihydro-1H-inden-4-yl)urea.

Molecular Properties

• Compound Name: 1-[5-(cyclobuten-1-yl)-2,3-dihydro-1H-inden-4-yl]-3-(3-oxa-8-azatricyclo[6.2.2.02,6]dodeca-2(6),4-dien-4-ylsulfonyl)urea;1-[(3-cyclopropyl-3,4,8-triazatricyclo[6.2.2.02,6]dodeca-2(6),4-dien-5-yl)sulfonyl]-3-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)propan-2-one;1-[(3-cyclopropyl-3,4,8-triazatricyclo[6.2.2.02,6]dodeca-2(6),4-dien-5-yl)sulfonyl]-3-[5-(2-methoxy-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]propan-2-one;1-[2-(2-methoxy-4-pyridinyl)-5,6-dihydro-4H-cyclopenta[b]thiophen-3-yl]-3-(3-thia-8-azatricyclo[6.2.2.02,6]dodeca-2(6),4-dien-4-ylsulfonyl)urea;1-[2-(2-methoxy-4-pyridinyl)-5,6-dihydro-4H-cyclopenta[b]thiophen-3-yl]-3-(2,3,8-triazatricyclo[6.2.2.02,6]dodeca-3,5-dien-4-ylsulfonyl)urea;1-(3-oxa-8-azatricyclo[6.2.2.02,6]dodeca-2(6),4-dien-4-ylsulfonyl)-3-(5-prop-1-ynyl-2,3-dihydro-1H-inden-4-yl)urea
• PubChem CID: 161307976
• Molecular Formula: C151H171N23O23S9
• Molecular Weight: 2964.77 g/mol
• Exact Mass: 2962.04
• IUPAC Name: 1-[5-(cyclobuten-1-yl)-2,3-dihydro-1H-inden-4-yl]-3-(3-oxa-8-azatricyclo[6.2.2.02,6]dodeca-2(6),4-dien-4-ylsulfonyl)urea;1-[(3-cyclopropyl-3,4,8-triazatricyclo[6.2.2.02,6]dodeca-2(6),4-dien-5-yl)sulfonyl]-3-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)propan-2-one;1-[(3-cyclopropyl-3,4,8-triazatricyclo[6.2.2.02,6]dodeca-2(6),4-dien-5-yl)sulfonyl]-3-[5-(2-methoxy-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]propan-2-one;1-[2-(2-methoxy-4-pyridinyl)-5,6-dihydro-4H-cyclopenta[b]thiophen-3-yl]-3-(3-thia-8-azatricyclo[6.2.2.02,6]dodeca-2(6),4-dien-4-ylsulfonyl)urea;1-[2-(2-methoxy-4-pyridinyl)-5,6-dihydro-4H-cyclopenta[b]thiophen-3-yl]-3-(2,3,8-triazatricyclo[6.2.2.02,6]dodeca-3,5-dien-4-ylsulfonyl)urea;1-(3-oxa-8-azatricyclo[6.2.2.02,6]dodeca-2(6),4-dien-4-ylsulfonyl)-3-(5-prop-1-ynyl-2,3-dihydro-1H-inden-4-yl)urea
• SMILES: CC#Cc1ccc2c(c1NC(=O)NS(=O)(=O)c1cc3c(o1)C1CCN(CC1)C3)CCC2.COc1cc(-c2ccc3c(c2CC(=O)CS(=O)(=O)c2nn(C4CC4)c4c2CN2CCC4CC2)CCC3)ccn1.COc1cc(-c2sc3c(c2NC(=O)NS(=O)(=O)c2cc4c(s2)C2CCN(CC2)C4)CCC3)ccn1.COc1cc(-c2sc3c(c2NC(=O)NS(=O)(=O)c2cc4n(n2)C2CCN(CC2)C4)CCC3)ccn1.O=C(Cc1c2c(cc3c1CCC3)CCC2)CS(=O)(=O)c1nn(C2CC2)c2c1CN1CCC2CC1.O=C(Nc1c(C2=CCC2)ccc2c1CCC2)NS(=O)(=O)c1cc2c(o1)C1CCN(CC1)C2
• InChI: InChI=1S/C30H34N4O4S.C27H33N3O3S.C24H26N4O4S3.C24H27N3O4S.C23H26N6O4S2.C23H25N3O4S/c1-38-28-15-21(9-12-31-28)25-8-5-19-3-2-4-24(19)26(25)16-23(35)18-39(36,37)30-27-17-33-13-10-20(11-14-33)29(27)34(32-30)22-6-7-22;31-21(14-24-22-5-1-3-18(22)13-19-4-2-6-23(19)24)16-34(32,33)27-25-15-29-11-9-17(10-12-29)26(25)30(28-27)20-7-8-20;1-32-19-11-15(5-8-25-19)23-21(17-3-2-4-18(17)33-23)26-24(29)27-35(30,31)20-12-16-13-28-9-6-14(7-10-28)22(16)34-20;28-24(25-22-19-6-2-5-16(19)7-8-20(22)15-3-1-4-15)26-32(29,30)21-13-18-14-27-11-9-17(10-12-27)23(18)31-21;1-33-19-11-14(5-8-24-19)22-21(17-3-2-4-18(17)34-22)25-23(30)27-35(31,32)20-12-16-13-28-9-6-15(7-10-28)29(16)26-20;1-2-4-16-8-7-15-5-3-6-19(15)21(16)24-23(27)25-31(28,29)20-13-18-14-26-11-9-17(10-12-26)22(18)30-20/h5,8-9,12,15,20,22H,2-4,6-7,10-11,13-14,16-18H2,1H3;13,17,20H,1-12,14-16H2;5,8,11-12,14H,2-4,6-7,9-10,13H2,1H3,(H2,26,27,29);3,7-8,13,17H,1-2,4-6,9-12,14H2,(H2,25,26,28);5,8,11-12,15H,2-4,6-7,9-10,13H2,1H3,(H2,25,27,30);7-8,13,17H,3,5-6,9-12,14H2,1H3,(H2,24,25,27)
• InChIKey: VIMXFILVAZZLMF-UHFFFAOYSA-N
• XLogP: 22.76
• TPSA: 569.04 Ų
• H-Bond Donors: 8
• H-Bond Acceptors: 41
• Rotatable Bonds: 31
• Heavy Atoms: 206
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2964.77
LogP ≤ 5	22.76
H-Bond Donors ≤ 5	8
H-Bond Acceptors ≤ 10	41

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'triple_bond', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 1-[5-(cyclobuten-1-yl)-2,3-dihydro-1H-inden-4-yl]-3-(3-oxa-8-azatricyclo[6.2.2.02,6]dodeca-2(6),4-dien-4-ylsulfonyl)urea;1-[(3-cyclopropyl-3,4,8-triazatricyclo[6.2.2.02,6]dodeca-2(6),4-dien-5-yl)sulfonyl]-3-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)propan-2-one;1-[(3-cyclopropyl-3,4,8-triazatricyclo[6.2.2.02,6]dodeca-2(6),4-dien-5-yl)sulfonyl]-3-[5-(2-methoxy-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]propan-2-one;1-[2-(2-methoxy-4-pyridinyl)-5,6-dihydro-4H-cyclopenta[b]thiophen-3-yl]-3-(3-thia-8-azatricyclo[6.2.2.02,6]dodeca-2(6),4-dien-4-ylsulfonyl)urea;1-[2-(2-methoxy-4-pyridinyl)-5,6-dihydro-4H-cyclopenta[b]thiophen-3-yl]-3-(2,3,8-triazatricyclo[6.2.2.02,6]dodeca-3,5-dien-4-ylsulfonyl)urea;1-(3-oxa-8-azatricyclo[6.2.2.02,6]dodeca-2(6),4-dien-4-ylsulfonyl)-3-(5-prop-1-ynyl-2,3-dihydro-1H-inden-4-yl)urea?

The IUPAC name of 1-[5-(cyclobuten-1-yl)-2,3-dihydro-1H-inden-4-yl]-3-(3-oxa-8-azatricyclo[6.2.2.02,6]dodeca-2(6),4-dien-4-ylsulfonyl)urea;1-[(3-cyclopropyl-3,4,8-triazatricyclo[6.2.2.02,6]dodeca-2(6),4-dien-5-yl)sulfonyl]-3-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)propan-2-one;1-[(3-cyclopropyl-3,4,8-triazatricyclo[6.2.2.02,6]dodeca-2(6),4-dien-5-yl)sulfonyl]-3-[5-(2-methoxy-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]propan-2-one;1-[2-(2-methoxy-4-pyridinyl)-5,6-dihydro-4H-cyclopenta[b]thiophen-3-yl]-3-(3-thia-8-azatricyclo[6.2.2.02,6]dodeca-2(6),4-dien-4-ylsulfonyl)urea;1-[2-(2-methoxy-4-pyridinyl)-5,6-dihydro-4H-cyclopenta[b]thiophen-3-yl]-3-(2,3,8-triazatricyclo[6.2.2.02,6]dodeca-3,5-dien-4-ylsulfonyl)urea;1-(3-oxa-8-azatricyclo[6.2.2.02,6]dodeca-2(6),4-dien-4-ylsulfonyl)-3-(5-prop-1-ynyl-2,3-dihydro-1H-inden-4-yl)urea (CID 161307976) is 1-[5-(cyclobuten-1-yl)-2,3-dihydro-1H-inden-4-yl]-3-(3-oxa-8-azatricyclo[6.2.2.02,6]dodeca-2(6),4-dien-4-ylsulfonyl)urea;1-[(3-cyclopropyl-3,4,8-triazatricyclo[6.2.2.02,6]dodeca-2(6),4-dien-5-yl)sulfonyl]-3-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)propan-2-one;1-[(3-cyclopropyl-3,4,8-triazatricyclo[6.2.2.02,6]dodeca-2(6),4-dien-5-yl)sulfonyl]-3-[5-(2-methoxy-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]propan-2-one;1-[2-(2-methoxy-4-pyridinyl)-5,6-dihydro-4H-cyclopenta[b]thiophen-3-yl]-3-(3-thia-8-azatricyclo[6.2.2.02,6]dodeca-2(6),4-dien-4-ylsulfonyl)urea;1-[2-(2-methoxy-4-pyridinyl)-5,6-dihydro-4H-cyclopenta[b]thiophen-3-yl]-3-(2,3,8-triazatricyclo[6.2.2.02,6]dodeca-3,5-dien-4-ylsulfonyl)urea;1-(3-oxa-8-azatricyclo[6.2.2.02,6]dodeca-2(6),4-dien-4-ylsulfonyl)-3-(5-prop-1-ynyl-2,3-dihydro-1H-inden-4-yl)urea.

What is the SMILES notation for 1-[5-(cyclobuten-1-yl)-2,3-dihydro-1H-inden-4-yl]-3-(3-oxa-8-azatricyclo[6.2.2.02,6]dodeca-2(6),4-dien-4-ylsulfonyl)urea;1-[(3-cyclopropyl-3,4,8-triazatricyclo[6.2.2.02,6]dodeca-2(6),4-dien-5-yl)sulfonyl]-3-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)propan-2-one;1-[(3-cyclopropyl-3,4,8-triazatricyclo[6.2.2.02,6]dodeca-2(6),4-dien-5-yl)sulfonyl]-3-[5-(2-methoxy-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]propan-2-one;1-[2-(2-methoxy-4-pyridinyl)-5,6-dihydro-4H-cyclopenta[b]thiophen-3-yl]-3-(3-thia-8-azatricyclo[6.2.2.02,6]dodeca-2(6),4-dien-4-ylsulfonyl)urea;1-[2-(2-methoxy-4-pyridinyl)-5,6-dihydro-4H-cyclopenta[b]thiophen-3-yl]-3-(2,3,8-triazatricyclo[6.2.2.02,6]dodeca-3,5-dien-4-ylsulfonyl)urea;1-(3-oxa-8-azatricyclo[6.2.2.02,6]dodeca-2(6),4-dien-4-ylsulfonyl)-3-(5-prop-1-ynyl-2,3-dihydro-1H-inden-4-yl)urea?

The canonical SMILES for 1-[5-(cyclobuten-1-yl)-2,3-dihydro-1H-inden-4-yl]-3-(3-oxa-8-azatricyclo[6.2.2.02,6]dodeca-2(6),4-dien-4-ylsulfonyl)urea;1-[(3-cyclopropyl-3,4,8-triazatricyclo[6.2.2.02,6]dodeca-2(6),4-dien-5-yl)sulfonyl]-3-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)propan-2-one;1-[(3-cyclopropyl-3,4,8-triazatricyclo[6.2.2.02,6]dodeca-2(6),4-dien-5-yl)sulfonyl]-3-[5-(2-methoxy-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]propan-2-one;1-[2-(2-methoxy-4-pyridinyl)-5,6-dihydro-4H-cyclopenta[b]thiophen-3-yl]-3-(3-thia-8-azatricyclo[6.2.2.02,6]dodeca-2(6),4-dien-4-ylsulfonyl)urea;1-[2-(2-methoxy-4-pyridinyl)-5,6-dihydro-4H-cyclopenta[b]thiophen-3-yl]-3-(2,3,8-triazatricyclo[6.2.2.02,6]dodeca-3,5-dien-4-ylsulfonyl)urea;1-(3-oxa-8-azatricyclo[6.2.2.02,6]dodeca-2(6),4-dien-4-ylsulfonyl)-3-(5-prop-1-ynyl-2,3-dihydro-1H-inden-4-yl)urea is CC#Cc1ccc2c(c1NC(=O)NS(=O)(=O)c1cc3c(o1)C1CCN(CC1)C3)CCC2.COc1cc(-c2ccc3c(c2CC(=O)CS(=O)(=O)c2nn(C4CC4)c4c2CN2CCC4CC2)CCC3)ccn1.COc1cc(-c2sc3c(c2NC(=O)NS(=O)(=O)c2cc4c(s2)C2CCN(CC2)C4)CCC3)ccn1.COc1cc(-c2sc3c(c2NC(=O)NS(=O)(=O)c2cc4n(n2)C2CCN(CC2)C4)CCC3)ccn1.O=C(Cc1c2c(cc3c1CCC3)CCC2)CS(=O)(=O)c1nn(C2CC2)c2c1CN1CCC2CC1.O=C(Nc1c(C2=CCC2)ccc2c1CCC2)NS(=O)(=O)c1cc2c(o1)C1CCN(CC1)C2.

What is the InChIKey of 1-[5-(cyclobuten-1-yl)-2,3-dihydro-1H-inden-4-yl]-3-(3-oxa-8-azatricyclo[6.2.2.02,6]dodeca-2(6),4-dien-4-ylsulfonyl)urea;1-[(3-cyclopropyl-3,4,8-triazatricyclo[6.2.2.02,6]dodeca-2(6),4-dien-5-yl)sulfonyl]-3-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)propan-2-one;1-[(3-cyclopropyl-3,4,8-triazatricyclo[6.2.2.02,6]dodeca-2(6),4-dien-5-yl)sulfonyl]-3-[5-(2-methoxy-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]propan-2-one;1-[2-(2-methoxy-4-pyridinyl)-5,6-dihydro-4H-cyclopenta[b]thiophen-3-yl]-3-(3-thia-8-azatricyclo[6.2.2.02,6]dodeca-2(6),4-dien-4-ylsulfonyl)urea;1-[2-(2-methoxy-4-pyridinyl)-5,6-dihydro-4H-cyclopenta[b]thiophen-3-yl]-3-(2,3,8-triazatricyclo[6.2.2.02,6]dodeca-3,5-dien-4-ylsulfonyl)urea;1-(3-oxa-8-azatricyclo[6.2.2.02,6]dodeca-2(6),4-dien-4-ylsulfonyl)-3-(5-prop-1-ynyl-2,3-dihydro-1H-inden-4-yl)urea?

The InChIKey is VIMXFILVAZZLMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H34N4O4S.C27H33N3O3S.C24H26N4O4S3.C24H27N3O4S.C23H26N6O4S2.C23H25N3O4S/c1-38-28-15-21(9-12-31-28)25-8-5-19-3-2-4-24(19)26(25)16-23(35)18-39(36,37)30-27-17-33-13-10-20(11-14-33)29(27)34(32-30)22-6-7-22;31-21(14-24-22-5-1-3-18(22)13-19-4-2-6-23(19)24)16-34(32,33)27-25-15-29-11-9-17(10-12-29)26(25)30(28-27)20-7-8-20;1-32-19-11-15(5-8-25-19)23-21(17-3-2-4-18(17)33-23)26-24(29)27-35(30,31)20-12-16-13-28-9-6-14(7-10-28)22(16)34-20;28-24(25-22-19-6-2-5-16(19)7-8-20(22)15-3-1-4-15)26-32(29,30)21-13-18-14-27-11-9-17(10-12-27)23(18)31-21;1-33-19-11-14(5-8-24-19)22-21(17-3-2-4-18(17)34-22)25-23(30)27-35(31,32)20-12-16-13-28-9-6-15(7-10-28)29(16)26-20;1-2-4-16-8-7-15-5-3-6-19(15)21(16)24-23(27)25-31(28,29)20-13-18-14-26-11-9-17(10-12-26)22(18)30-20/h5,8-9,12,15,20,22H,2-4,6-7,10-11,13-14,16-18H2,1H3;13,17,20H,1-12,14-16H2;5,8,11-12,14H,2-4,6-7,9-10,13H2,1H3,(H2,26,27,29);3,7-8,13,17H,1-2,4-6,9-12,14H2,(H2,25,26,28);5,8,11-12,15H,2-4,6-7,9-10,13H2,1H3,(H2,25,27,30);7-8,13,17H,3,5-6,9-12,14H2,1H3,(H2,24,25,27).

What are the key properties of 1-[5-(cyclobuten-1-yl)-2,3-dihydro-1H-inden-4-yl]-3-(3-oxa-8-azatricyclo[6.2.2.02,6]dodeca-2(6),4-dien-4-ylsulfonyl)urea;1-[(3-cyclopropyl-3,4,8-triazatricyclo[6.2.2.02,6]dodeca-2(6),4-dien-5-yl)sulfonyl]-3-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)propan-2-one;1-[(3-cyclopropyl-3,4,8-triazatricyclo[6.2.2.02,6]dodeca-2(6),4-dien-5-yl)sulfonyl]-3-[5-(2-methoxy-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]propan-2-one;1-[2-(2-methoxy-4-pyridinyl)-5,6-dihydro-4H-cyclopenta[b]thiophen-3-yl]-3-(3-thia-8-azatricyclo[6.2.2.02,6]dodeca-2(6),4-dien-4-ylsulfonyl)urea;1-[2-(2-methoxy-4-pyridinyl)-5,6-dihydro-4H-cyclopenta[b]thiophen-3-yl]-3-(2,3,8-triazatricyclo[6.2.2.02,6]dodeca-3,5-dien-4-ylsulfonyl)urea;1-(3-oxa-8-azatricyclo[6.2.2.02,6]dodeca-2(6),4-dien-4-ylsulfonyl)-3-(5-prop-1-ynyl-2,3-dihydro-1H-inden-4-yl)urea?

1-[5-(cyclobuten-1-yl)-2,3-dihydro-1H-inden-4-yl]-3-(3-oxa-8-azatricyclo[6.2.2.02,6]dodeca-2(6),4-dien-4-ylsulfonyl)urea;1-[(3-cyclopropyl-3,4,8-triazatricyclo[6.2.2.02,6]dodeca-2(6),4-dien-5-yl)sulfonyl]-3-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)propan-2-one;1-[(3-cyclopropyl-3,4,8-triazatricyclo[6.2.2.02,6]dodeca-2(6),4-dien-5-yl)sulfonyl]-3-[5-(2-methoxy-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]propan-2-one;1-[2-(2-methoxy-4-pyridinyl)-5,6-dihydro-4H-cyclopenta[b]thiophen-3-yl]-3-(3-thia-8-azatricyclo[6.2.2.02,6]dodeca-2(6),4-dien-4-ylsulfonyl)urea;1-[2-(2-methoxy-4-pyridinyl)-5,6-dihydro-4H-cyclopenta[b]thiophen-3-yl]-3-(2,3,8-triazatricyclo[6.2.2.02,6]dodeca-3,5-dien-4-ylsulfonyl)urea;1-(3-oxa-8-azatricyclo[6.2.2.02,6]dodeca-2(6),4-dien-4-ylsulfonyl)-3-(5-prop-1-ynyl-2,3-dihydro-1H-inden-4-yl)urea has a molecular weight of 2964.77 g/mol, XLogP of 22.76, 31 rotatable bonds, 8 hydrogen bond donors, and 41 hydrogen bond acceptors.

Where does this data come from?

All data for 1-[5-(cyclobuten-1-yl)-2,3-dihydro-1H-inden-4-yl]-3-(3-oxa-8-azatricyclo[6.2.2.02,6]dodeca-2(6),4-dien-4-ylsulfonyl)urea;1-[(3-cyclopropyl-3,4,8-triazatricyclo[6.2.2.02,6]dodeca-2(6),4-dien-5-yl)sulfonyl]-3-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)propan-2-one;1-[(3-cyclopropyl-3,4,8-triazatricyclo[6.2.2.02,6]dodeca-2(6),4-dien-5-yl)sulfonyl]-3-[5-(2-methoxy-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]propan-2-one;1-[2-(2-methoxy-4-pyridinyl)-5,6-dihydro-4H-cyclopenta[b]thiophen-3-yl]-3-(3-thia-8-azatricyclo[6.2.2.02,6]dodeca-2(6),4-dien-4-ylsulfonyl)urea;1-[2-(2-methoxy-4-pyridinyl)-5,6-dihydro-4H-cyclopenta[b]thiophen-3-yl]-3-(2,3,8-triazatricyclo[6.2.2.02,6]dodeca-3,5-dien-4-ylsulfonyl)urea;1-(3-oxa-8-azatricyclo[6.2.2.02,6]dodeca-2(6),4-dien-4-ylsulfonyl)-3-(5-prop-1-ynyl-2,3-dihydro-1H-inden-4-yl)urea is sourced from PubChem (CID 161307976), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).