2-[2-[4-(cyclopropylmethyl)piperazin-1-yl]-3-pyridinyl]-7-methoxy-5-propan-2-yl-3,1-benzoxazin-4-one;2-[2-[(3R)-3-(dimethylamino)pyrrolidin-1-yl]-3-pyridinyl]-7-methoxy-5-propan-2-yl-3,1-benzoxazin-4-one;2-[2-[(3S)-3-(dimethylamino)pyrrolidin-1-yl]-3-pyridinyl]-7-methoxy-5-propan-2-yl-3,1-benzoxazin-4-one;2-(2-imidazol-1-yl-3-pyridinyl)-7-methoxy-5-propan-2-yl-3,1-benzoxazin-4-one;7-methoxy-2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-3-pyridinyl]-5-propan-2-yl-3,1-benzoxazin-4-one;7-methoxy-2-[2-(4-methylpiperazin-1-yl)-3-pyridinyl]-5-propan-2-yl-3,1-benzoxazin-4-one

C145H176N22O26 — CID 158123214

IUPAC2-[2-[4-(cyclopropylmethyl)piperazin-1-yl]-3-pyridinyl]-7-methoxy-5-propan-2-yl-3,1-benzoxazin-4-one;2-[2-[(3R)-3-(dimethylamino)pyrrolidin-1-yl]-3-pyridinyl]-7-methoxy-5-propan-2-yl-3,1-benzoxazin-4-one;2-[2-[(3S)-3-(dimethylamino)pyrrolidin-1-yl]-3-pyridinyl]-7-methoxy-5-propan-2-yl-3,1-benzoxazin-4-one;2-(2-imidazol-1-yl-3-pyridinyl)-7-methoxy-5-propan-2-yl-3,1-benzoxazin-4-one;7-methoxy-2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-3-pyridinyl]-5-propan-2-yl-3,1-benzoxazin-4-one;7-methoxy-2-[2-(4-methylpiperazin-1-yl)-3-pyridinyl]-5-propan-2-yl-3,1-benzoxazin-4-one
SMILESCOCCOCCOCCOCCOCCOCCOCCOc1ncccc1-c1nc2cc(OC)cc(C(C)C)c2c(=O)o1.COc1cc(C(C)C)c2c(=O)oc(-c3cccnc3-n3ccnc3)nc2c1.COc1cc(C(C)C)c2c(=O)oc(-c3cccnc3N3CCN(C)CC3)nc2c1.COc1cc(C(C)C)c2c(=O)oc(-c3cccnc3N3CCN(CC4CC4)CC3)nc2c1.COc1cc(C(C)C)c2c(=O)oc(-c3cccnc3N3CC[C@@H](N(C)C)C3)nc2c1.COc1cc(C(C)C)c2c(=O)oc(-c3cccnc3N3CC[C@H](N(C)C)C3)nc2c1
InChIInChI=1S/C32H46N2O11.C25H30N4O3.2C23H28N4O3.C22H26N4O3.C20H18N4O3/c1-24(2)27-22-25(37-4)23-28-29(27)32(35)45-31(34-28)26-6-5-7-33-30(26)44-21-20-43-19-18-42-17-16-41-15-14-40-13-12-39-11-10-38-9-8-36-3;1-16(2)20-13-18(31-3)14-21-22(20)25(30)32-24(27-21)19-5-4-8-26-23(19)29-11-9-28(10-12-29)15-17-6-7-17;2*1-14(2)18-11-16(29-5)12-19-20(18)23(28)30-22(25-19)17-7-6-9-24-21(17)27-10-8-15(13-27)26(3)4;1-14(2)17-12-15(28-4)13-18-19(17)22(27)29-21(24-18)16-6-5-7-23-20(16)26-10-8-25(3)9-11-26;1-12(2)15-9-13(26-3)10-16-17(15)20(25)27-19(23-16)14-5-4-6-22-18(14)24-8-7-21-11-24/h5-7,22-24H,8-21H2,1-4H3;4-5,8,13-14,16-17H,6-7,9-12,15H2,1-3H3;2*6-7,9,11-12,14-15H,8,10,13H2,1-5H3;5-7,12-14H,8-11H2,1-4H3;4-12H,1-3H3/t;;2*15-;;/m..10../s1
InChIKeyFRVSYGYEDZMIRN-YUOPEDRHSA-N
MW2643.13 g/mol
LogP21.17
Rot. Bonds49

About 2-[2-[4-(cyclopropylmethyl)piperazin-1-yl]-3-pyridinyl]-7-methoxy-5-propan-2-yl-3,1-benzoxazin-4-one;2-[2-[(3R)-3-(dimethylamino)pyrrolidin-1-yl]-3-pyridinyl]-7-methoxy-5-propan-2-yl-3,1-benzoxazin-4-one;2-[2-[(3S)-3-(dimethylamino)pyrrolidin-1-yl]-3-pyridinyl]-7-methoxy-5-propan-2-yl-3,1-benzoxazin-4-one;2-(2-imidazol-1-yl-3-pyridinyl)-7-methoxy-5-propan-2-yl-3,1-benzoxazin-4-one;7-methoxy-2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-3-pyridinyl]-5-propan-2-yl-3,1-benzoxazin-4-one;7-methoxy-2-[2-(4-methylpiperazin-1-yl)-3-pyridinyl]-5-propan-2-yl-3,1-benzoxazin-4-one

2-[2-[4-(cyclopropylmethyl)piperazin-1-yl]-3-pyridinyl]-7-methoxy-5-propan-2-yl-3,1-benzoxazin-4-one;2-[2-[(3R)-3-(dimethylamino)pyrrolidin-1-yl]-3-pyridinyl]-7-methoxy-5-propan-2-yl-3,1-benzoxazin-4-one;2-[2-[(3S)-3-(dimethylamino)pyrrolidin-1-yl]-3-pyridinyl]-7-methoxy-5-propan-2-yl-3,1-benzoxazin-4-one;2-(2-imidazol-1-yl-3-pyridinyl)-7-methoxy-5-propan-2-yl-3,1-benzoxazin-4-one;7-methoxy-2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-3-pyridinyl]-5-propan-2-yl-3,1-benzoxazin-4-one;7-methoxy-2-[2-(4-methylpiperazin-1-yl)-3-pyridinyl]-5-propan-2-yl-3,1-benzoxazin-4-one (PubChem CID 158123214) has the molecular formula C145H176N22O26 and a molecular weight of 2643.13 g/mol. Its IUPAC name is 2-[2-[4-(cyclopropylmethyl)piperazin-1-yl]-3-pyridinyl]-7-methoxy-5-propan-2-yl-3,1-benzoxazin-4-one;2-[2-[(3R)-3-(dimethylamino)pyrrolidin-1-yl]-3-pyridinyl]-7-methoxy-5-propan-2-yl-3,1-benzoxazin-4-one;2-[2-[(3S)-3-(dimethylamino)pyrrolidin-1-yl]-3-pyridinyl]-7-methoxy-5-propan-2-yl-3,1-benzoxazin-4-one;2-(2-imidazol-1-yl-3-pyridinyl)-7-methoxy-5-propan-2-yl-3,1-benzoxazin-4-one;7-methoxy-2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-3-pyridinyl]-5-propan-2-yl-3,1-benzoxazin-4-one;7-methoxy-2-[2-(4-methylpiperazin-1-yl)-3-pyridinyl]-5-propan-2-yl-3,1-benzoxazin-4-one.

Molecular Properties

Compound Name2-[2-[4-(cyclopropylmethyl)piperazin-1-yl]-3-pyridinyl]-7-methoxy-5-propan-2-yl-3,1-benzoxazin-4-one;2-[2-[(3R)-3-(dimethylamino)pyrrolidin-1-yl]-3-pyridinyl]-7-methoxy-5-propan-2-yl-3,1-benzoxazin-4-one;2-[2-[(3S)-3-(dimethylamino)pyrrolidin-1-yl]-3-pyridinyl]-7-methoxy-5-propan-2-yl-3,1-benzoxazin-4-one;2-(2-imidazol-1-yl-3-pyridinyl)-7-methoxy-5-propan-2-yl-3,1-benzoxazin-4-one;7-methoxy-2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-3-pyridinyl]-5-propan-2-yl-3,1-benzoxazin-4-one;7-methoxy-2-[2-(4-methylpiperazin-1-yl)-3-pyridinyl]-5-propan-2-yl-3,1-benzoxazin-4-one
PubChem CID158123214
Molecular FormulaC145H176N22O26
Molecular Weight2643.13 g/mol
Exact Mass2641.31
IUPAC Name2-[2-[4-(cyclopropylmethyl)piperazin-1-yl]-3-pyridinyl]-7-methoxy-5-propan-2-yl-3,1-benzoxazin-4-one;2-[2-[(3R)-3-(dimethylamino)pyrrolidin-1-yl]-3-pyridinyl]-7-methoxy-5-propan-2-yl-3,1-benzoxazin-4-one;2-[2-[(3S)-3-(dimethylamino)pyrrolidin-1-yl]-3-pyridinyl]-7-methoxy-5-propan-2-yl-3,1-benzoxazin-4-one;2-(2-imidazol-1-yl-3-pyridinyl)-7-methoxy-5-propan-2-yl-3,1-benzoxazin-4-one;7-methoxy-2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-3-pyridinyl]-5-propan-2-yl-3,1-benzoxazin-4-one;7-methoxy-2-[2-(4-methylpiperazin-1-yl)-3-pyridinyl]-5-propan-2-yl-3,1-benzoxazin-4-one
SMILESCOCCOCCOCCOCCOCCOCCOCCOc1ncccc1-c1nc2cc(OC)cc(C(C)C)c2c(=O)o1.COc1cc(C(C)C)c2c(=O)oc(-c3cccnc3-n3ccnc3)nc2c1.COc1cc(C(C)C)c2c(=O)oc(-c3cccnc3N3CCN(C)CC3)nc2c1.COc1cc(C(C)C)c2c(=O)oc(-c3cccnc3N3CCN(CC4CC4)CC3)nc2c1.COc1cc(C(C)C)c2c(=O)oc(-c3cccnc3N3CC[C@@H](N(C)C)C3)nc2c1.COc1cc(C(C)C)c2c(=O)oc(-c3cccnc3N3CC[C@H](N(C)C)C3)nc2c1
InChIInChI=1S/C32H46N2O11.C25H30N4O3.2C23H28N4O3.C22H26N4O3.C20H18N4O3/c1-24(2)27-22-25(37-4)23-28-29(27)32(35)45-31(34-28)26-6-5-7-33-30(26)44-21-20-43-19-18-42-17-16-41-15-14-40-13-12-39-11-10-38-9-8-36-3;1-16(2)20-13-18(31-3)14-21-22(20)25(30)32-24(27-21)19-5-4-8-26-23(19)29-11-9-28(10-12-29)15-17-6-7-17;2*1-14(2)18-11-16(29-5)12-19-20(18)23(28)30-22(25-19)17-7-6-9-24-21(17)27-10-8-15(13-27)26(3)4;1-14(2)17-12-15(28-4)13-18-19(17)22(27)29-21(24-18)16-6-5-7-23-20(16)26-10-8-25(3)9-11-26;1-12(2)15-9-13(26-3)10-16-17(15)20(25)27-19(23-16)14-5-4-6-22-18(14)24-8-7-21-11-24/h5-7,22-24H,8-21H2,1-4H3;4-5,8,13-14,16-17H,6-7,9-12,15H2,1-3H3;2*6-7,9,11-12,14-15H,8,10,13H2,1-5H3;5-7,12-14H,8-11H2,1-4H3;4-12H,1-3H3/t;;2*15-;;/m..10../s1
InChIKeyFRVSYGYEDZMIRN-YUOPEDRHSA-N
XLogP21.17
TPSA508.90 Ų
H-Bond Donors
H-Bond Acceptors48
Rotatable Bonds49
Heavy Atoms193
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002643.13
LogP ≤ 521.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1048

Computed Properties (RDKit)

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

Analyze 2-[2-[4-(cyclopropylmethyl)piperazin-1-yl]-3-pyridinyl]-7-methoxy-5-propan-2-yl-3,1-benzoxazin-4-one;2-[2-[(3R)-3-(dimethylamino)pyrrolidin-1-yl]-3-pyridinyl]-7-methoxy-5-propan-2-yl-3,1-benzoxazin-4-one;2-[2-[(3S)-3-(dimethylamino)pyrrolidin-1-yl]-3-pyridinyl]-7-methoxy-5-propan-2-yl-3,1-benzoxazin-4-one;2-(2-imidazol-1-yl-3-pyridinyl)-7-methoxy-5-propan-2-yl-3,1-benzoxazin-4-one;7-methoxy-2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-3-pyridinyl]-5-propan-2-yl-3,1-benzoxazin-4-one;7-methoxy-2-[2-(4-methylpiperazin-1-yl)-3-pyridinyl]-5-propan-2-yl-3,1-benzoxazin-4-one with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-[2-[4-(cyclopropylmethyl)piperazin-1-yl]-3-pyridinyl]-7-methoxy-5-propan-2-yl-3,1-benzoxazin-4-one;2-[2-[(3R)-3-(dimethylamino)pyrrolidin-1-yl]-3-pyridinyl]-7-methoxy-5-propan-2-yl-3,1-benzoxazin-4-one;2-[2-[(3S)-3-(dimethylamino)pyrrolidin-1-yl]-3-pyridinyl]-7-methoxy-5-propan-2-yl-3,1-benzoxazin-4-one;2-(2-imidazol-1-yl-3-pyridinyl)-7-methoxy-5-propan-2-yl-3,1-benzoxazin-4-one;7-methoxy-2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-3-pyridinyl]-5-propan-2-yl-3,1-benzoxazin-4-one;7-methoxy-2-[2-(4-methylpiperazin-1-yl)-3-pyridinyl]-5-propan-2-yl-3,1-benzoxazin-4-one?
The IUPAC name of 2-[2-[4-(cyclopropylmethyl)piperazin-1-yl]-3-pyridinyl]-7-methoxy-5-propan-2-yl-3,1-benzoxazin-4-one;2-[2-[(3R)-3-(dimethylamino)pyrrolidin-1-yl]-3-pyridinyl]-7-methoxy-5-propan-2-yl-3,1-benzoxazin-4-one;2-[2-[(3S)-3-(dimethylamino)pyrrolidin-1-yl]-3-pyridinyl]-7-methoxy-5-propan-2-yl-3,1-benzoxazin-4-one;2-(2-imidazol-1-yl-3-pyridinyl)-7-methoxy-5-propan-2-yl-3,1-benzoxazin-4-one;7-methoxy-2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-3-pyridinyl]-5-propan-2-yl-3,1-benzoxazin-4-one;7-methoxy-2-[2-(4-methylpiperazin-1-yl)-3-pyridinyl]-5-propan-2-yl-3,1-benzoxazin-4-one (CID 158123214) is 2-[2-[4-(cyclopropylmethyl)piperazin-1-yl]-3-pyridinyl]-7-methoxy-5-propan-2-yl-3,1-benzoxazin-4-one;2-[2-[(3R)-3-(dimethylamino)pyrrolidin-1-yl]-3-pyridinyl]-7-methoxy-5-propan-2-yl-3,1-benzoxazin-4-one;2-[2-[(3S)-3-(dimethylamino)pyrrolidin-1-yl]-3-pyridinyl]-7-methoxy-5-propan-2-yl-3,1-benzoxazin-4-one;2-(2-imidazol-1-yl-3-pyridinyl)-7-methoxy-5-propan-2-yl-3,1-benzoxazin-4-one;7-methoxy-2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-3-pyridinyl]-5-propan-2-yl-3,1-benzoxazin-4-one;7-methoxy-2-[2-(4-methylpiperazin-1-yl)-3-pyridinyl]-5-propan-2-yl-3,1-benzoxazin-4-one.
What is the SMILES notation for 2-[2-[4-(cyclopropylmethyl)piperazin-1-yl]-3-pyridinyl]-7-methoxy-5-propan-2-yl-3,1-benzoxazin-4-one;2-[2-[(3R)-3-(dimethylamino)pyrrolidin-1-yl]-3-pyridinyl]-7-methoxy-5-propan-2-yl-3,1-benzoxazin-4-one;2-[2-[(3S)-3-(dimethylamino)pyrrolidin-1-yl]-3-pyridinyl]-7-methoxy-5-propan-2-yl-3,1-benzoxazin-4-one;2-(2-imidazol-1-yl-3-pyridinyl)-7-methoxy-5-propan-2-yl-3,1-benzoxazin-4-one;7-methoxy-2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-3-pyridinyl]-5-propan-2-yl-3,1-benzoxazin-4-one;7-methoxy-2-[2-(4-methylpiperazin-1-yl)-3-pyridinyl]-5-propan-2-yl-3,1-benzoxazin-4-one?
The canonical SMILES for 2-[2-[4-(cyclopropylmethyl)piperazin-1-yl]-3-pyridinyl]-7-methoxy-5-propan-2-yl-3,1-benzoxazin-4-one;2-[2-[(3R)-3-(dimethylamino)pyrrolidin-1-yl]-3-pyridinyl]-7-methoxy-5-propan-2-yl-3,1-benzoxazin-4-one;2-[2-[(3S)-3-(dimethylamino)pyrrolidin-1-yl]-3-pyridinyl]-7-methoxy-5-propan-2-yl-3,1-benzoxazin-4-one;2-(2-imidazol-1-yl-3-pyridinyl)-7-methoxy-5-propan-2-yl-3,1-benzoxazin-4-one;7-methoxy-2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-3-pyridinyl]-5-propan-2-yl-3,1-benzoxazin-4-one;7-methoxy-2-[2-(4-methylpiperazin-1-yl)-3-pyridinyl]-5-propan-2-yl-3,1-benzoxazin-4-one is COCCOCCOCCOCCOCCOCCOCCOc1ncccc1-c1nc2cc(OC)cc(C(C)C)c2c(=O)o1.COc1cc(C(C)C)c2c(=O)oc(-c3cccnc3-n3ccnc3)nc2c1.COc1cc(C(C)C)c2c(=O)oc(-c3cccnc3N3CCN(C)CC3)nc2c1.COc1cc(C(C)C)c2c(=O)oc(-c3cccnc3N3CCN(CC4CC4)CC3)nc2c1.COc1cc(C(C)C)c2c(=O)oc(-c3cccnc3N3CC[C@@H](N(C)C)C3)nc2c1.COc1cc(C(C)C)c2c(=O)oc(-c3cccnc3N3CC[C@H](N(C)C)C3)nc2c1.
What is the InChIKey of 2-[2-[4-(cyclopropylmethyl)piperazin-1-yl]-3-pyridinyl]-7-methoxy-5-propan-2-yl-3,1-benzoxazin-4-one;2-[2-[(3R)-3-(dimethylamino)pyrrolidin-1-yl]-3-pyridinyl]-7-methoxy-5-propan-2-yl-3,1-benzoxazin-4-one;2-[2-[(3S)-3-(dimethylamino)pyrrolidin-1-yl]-3-pyridinyl]-7-methoxy-5-propan-2-yl-3,1-benzoxazin-4-one;2-(2-imidazol-1-yl-3-pyridinyl)-7-methoxy-5-propan-2-yl-3,1-benzoxazin-4-one;7-methoxy-2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-3-pyridinyl]-5-propan-2-yl-3,1-benzoxazin-4-one;7-methoxy-2-[2-(4-methylpiperazin-1-yl)-3-pyridinyl]-5-propan-2-yl-3,1-benzoxazin-4-one?
The InChIKey is FRVSYGYEDZMIRN-YUOPEDRHSA-N. The full InChI is InChI=1S/C32H46N2O11.C25H30N4O3.2C23H28N4O3.C22H26N4O3.C20H18N4O3/c1-24(2)27-22-25(37-4)23-28-29(27)32(35)45-31(34-28)26-6-5-7-33-30(26)44-21-20-43-19-18-42-17-16-41-15-14-40-13-12-39-11-10-38-9-8-36-3;1-16(2)20-13-18(31-3)14-21-22(20)25(30)32-24(27-21)19-5-4-8-26-23(19)29-11-9-28(10-12-29)15-17-6-7-17;2*1-14(2)18-11-16(29-5)12-19-20(18)23(28)30-22(25-19)17-7-6-9-24-21(17)27-10-8-15(13-27)26(3)4;1-14(2)17-12-15(28-4)13-18-19(17)22(27)29-21(24-18)16-6-5-7-23-20(16)26-10-8-25(3)9-11-26;1-12(2)15-9-13(26-3)10-16-17(15)20(25)27-19(23-16)14-5-4-6-22-18(14)24-8-7-21-11-24/h5-7,22-24H,8-21H2,1-4H3;4-5,8,13-14,16-17H,6-7,9-12,15H2,1-3H3;2*6-7,9,11-12,14-15H,8,10,13H2,1-5H3;5-7,12-14H,8-11H2,1-4H3;4-12H,1-3H3/t;;2*15-;;/m..10../s1.
What are the key properties of 2-[2-[4-(cyclopropylmethyl)piperazin-1-yl]-3-pyridinyl]-7-methoxy-5-propan-2-yl-3,1-benzoxazin-4-one;2-[2-[(3R)-3-(dimethylamino)pyrrolidin-1-yl]-3-pyridinyl]-7-methoxy-5-propan-2-yl-3,1-benzoxazin-4-one;2-[2-[(3S)-3-(dimethylamino)pyrrolidin-1-yl]-3-pyridinyl]-7-methoxy-5-propan-2-yl-3,1-benzoxazin-4-one;2-(2-imidazol-1-yl-3-pyridinyl)-7-methoxy-5-propan-2-yl-3,1-benzoxazin-4-one;7-methoxy-2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-3-pyridinyl]-5-propan-2-yl-3,1-benzoxazin-4-one;7-methoxy-2-[2-(4-methylpiperazin-1-yl)-3-pyridinyl]-5-propan-2-yl-3,1-benzoxazin-4-one?
2-[2-[4-(cyclopropylmethyl)piperazin-1-yl]-3-pyridinyl]-7-methoxy-5-propan-2-yl-3,1-benzoxazin-4-one;2-[2-[(3R)-3-(dimethylamino)pyrrolidin-1-yl]-3-pyridinyl]-7-methoxy-5-propan-2-yl-3,1-benzoxazin-4-one;2-[2-[(3S)-3-(dimethylamino)pyrrolidin-1-yl]-3-pyridinyl]-7-methoxy-5-propan-2-yl-3,1-benzoxazin-4-one;2-(2-imidazol-1-yl-3-pyridinyl)-7-methoxy-5-propan-2-yl-3,1-benzoxazin-4-one;7-methoxy-2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-3-pyridinyl]-5-propan-2-yl-3,1-benzoxazin-4-one;7-methoxy-2-[2-(4-methylpiperazin-1-yl)-3-pyridinyl]-5-propan-2-yl-3,1-benzoxazin-4-one has a molecular weight of 2643.13 g/mol, XLogP of 21.17, 49 rotatable bonds, 0 hydrogen bond donors, and 48 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[4-(cyclopropylmethyl)piperazin-1-yl]-3-pyridinyl]-7-methoxy-5-propan-2-yl-3,1-benzoxazin-4-one;2-[2-[(3R)-3-(dimethylamino)pyrrolidin-1-yl]-3-pyridinyl]-7-methoxy-5-propan-2-yl-3,1-benzoxazin-4-one;2-[2-[(3S)-3-(dimethylamino)pyrrolidin-1-yl]-3-pyridinyl]-7-methoxy-5-propan-2-yl-3,1-benzoxazin-4-one;2-(2-imidazol-1-yl-3-pyridinyl)-7-methoxy-5-propan-2-yl-3,1-benzoxazin-4-one;7-methoxy-2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-3-pyridinyl]-5-propan-2-yl-3,1-benzoxazin-4-one;7-methoxy-2-[2-(4-methylpiperazin-1-yl)-3-pyridinyl]-5-propan-2-yl-3,1-benzoxazin-4-one is sourced from PubChem (CID 158123214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).