4-nitrooxybutyl 7-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-6-oxo-1,2,3,4,7,8,9,10-octahydropyridazino[1,2-a]diazepine-4-carboxylate;2-(2-nitrooxyethoxy)ethyl 7-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-6-oxo-1,2,3,4,7,8,9,10-octahydropyridazino[1,2-a]diazepine-4-carboxylate;2-(2-nitrooxyethylsulfanyl)ethyl 7-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-6-oxo-1,2,3,4,7,8,9,10-octahydropyridazino[1,2-a]diazepine-4-carboxylate;5-nitrooxypentyl 7-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-6-oxo-1,2,3,4,7,8,9,10-octahydropyridazino[1,2-a]diazepine-4-carboxylate;7-[[1-(3-nitrooxypropoxy)-1-oxo-4-phenylbutan-2-yl]amino]-6-oxo-1,2,3,4,7,8,9,10-octahydropyridazino[1,2-a]diazepine-4-carboxylic acid;3-nitrooxypropyl 7-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-6-oxo-1,2,3,4,7,8,9,10-octahydropyridazino[1,2-a]diazepine-4-carboxylate

C153H222N24O49S — CID 159728444

About 4-nitrooxybutyl 7-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-6-oxo-1,2,3,4,7,8,9,10-octahydropyridazino[1,2-a]diazepine-4-carboxylate;2-(2-nitrooxyethoxy)ethyl 7-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-6-oxo-1,2,3,4,7,8,9,10-octahydropyridazino[1,2-a]diazepine-4-carboxylate;2-(2-nitrooxyethylsulfanyl)ethyl 7-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-6-oxo-1,2,3,4,7,8,9,10-octahydropyridazino[1,2-a]diazepine-4-carboxylate;5-nitrooxypentyl 7-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-6-oxo-1,2,3,4,7,8,9,10-octahydropyridazino[1,2-a]diazepine-4-carboxylate;7-[[1-(3-nitrooxypropoxy)-1-oxo-4-phenylbutan-2-yl]amino]-6-oxo-1,2,3,4,7,8,9,10-octahydropyridazino[1,2-a]diazepine-4-carboxylic acid;3-nitrooxypropyl 7-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-6-oxo-1,2,3,4,7,8,9,10-octahydropyridazino[1,2-a]diazepine-4-carboxylate

4-nitrooxybutyl 7-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-6-oxo-1,2,3,4,7,8,9,10-octahydropyridazino[1,2-a]diazepine-4-carboxylate;2-(2-nitrooxyethoxy)ethyl 7-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-6-oxo-1,2,3,4,7,8,9,10-octahydropyridazino[1,2-a]diazepine-4-carboxylate;2-(2-nitrooxyethylsulfanyl)ethyl 7-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-6-oxo-1,2,3,4,7,8,9,10-octahydropyridazino[1,2-a]diazepine-4-carboxylate;5-nitrooxypentyl 7-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-6-oxo-1,2,3,4,7,8,9,10-octahydropyridazino[1,2-a]diazepine-4-carboxylate;7-[[1-(3-nitrooxypropoxy)-1-oxo-4-phenylbutan-2-yl]amino]-6-oxo-1,2,3,4,7,8,9,10-octahydropyridazino[1,2-a]diazepine-4-carboxylic acid;3-nitrooxypropyl 7-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-6-oxo-1,2,3,4,7,8,9,10-octahydropyridazino[1,2-a]diazepine-4-carboxylate (PubChem CID 159728444) has the molecular formula C153H222N24O49S and a molecular weight of 3213.64 g/mol. Its IUPAC name is 4-nitrooxybutyl 7-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-6-oxo-1,2,3,4,7,8,9,10-octahydropyridazino[1,2-a]diazepine-4-carboxylate;2-(2-nitrooxyethoxy)ethyl 7-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-6-oxo-1,2,3,4,7,8,9,10-octahydropyridazino[1,2-a]diazepine-4-carboxylate;2-(2-nitrooxyethylsulfanyl)ethyl 7-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-6-oxo-1,2,3,4,7,8,9,10-octahydropyridazino[1,2-a]diazepine-4-carboxylate;5-nitrooxypentyl 7-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-6-oxo-1,2,3,4,7,8,9,10-octahydropyridazino[1,2-a]diazepine-4-carboxylate;7-[[1-(3-nitrooxypropoxy)-1-oxo-4-phenylbutan-2-yl]amino]-6-oxo-1,2,3,4,7,8,9,10-octahydropyridazino[1,2-a]diazepine-4-carboxylic acid;3-nitrooxypropyl 7-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-6-oxo-1,2,3,4,7,8,9,10-octahydropyridazino[1,2-a]diazepine-4-carboxylate.

Molecular Properties

• Compound Name: 4-nitrooxybutyl 7-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-6-oxo-1,2,3,4,7,8,9,10-octahydropyridazino[1,2-a]diazepine-4-carboxylate;2-(2-nitrooxyethoxy)ethyl 7-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-6-oxo-1,2,3,4,7,8,9,10-octahydropyridazino[1,2-a]diazepine-4-carboxylate;2-(2-nitrooxyethylsulfanyl)ethyl 7-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-6-oxo-1,2,3,4,7,8,9,10-octahydropyridazino[1,2-a]diazepine-4-carboxylate;5-nitrooxypentyl 7-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-6-oxo-1,2,3,4,7,8,9,10-octahydropyridazino[1,2-a]diazepine-4-carboxylate;7-[[1-(3-nitrooxypropoxy)-1-oxo-4-phenylbutan-2-yl]amino]-6-oxo-1,2,3,4,7,8,9,10-octahydropyridazino[1,2-a]diazepine-4-carboxylic acid;3-nitrooxypropyl 7-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-6-oxo-1,2,3,4,7,8,9,10-octahydropyridazino[1,2-a]diazepine-4-carboxylate
• PubChem CID: 159728444
• Molecular Formula: C153H222N24O49S
• Molecular Weight: 3213.64 g/mol
• Exact Mass: 3211.53
• IUPAC Name: 4-nitrooxybutyl 7-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-6-oxo-1,2,3,4,7,8,9,10-octahydropyridazino[1,2-a]diazepine-4-carboxylate;2-(2-nitrooxyethoxy)ethyl 7-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-6-oxo-1,2,3,4,7,8,9,10-octahydropyridazino[1,2-a]diazepine-4-carboxylate;2-(2-nitrooxyethylsulfanyl)ethyl 7-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-6-oxo-1,2,3,4,7,8,9,10-octahydropyridazino[1,2-a]diazepine-4-carboxylate;5-nitrooxypentyl 7-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-6-oxo-1,2,3,4,7,8,9,10-octahydropyridazino[1,2-a]diazepine-4-carboxylate;7-[[1-(3-nitrooxypropoxy)-1-oxo-4-phenylbutan-2-yl]amino]-6-oxo-1,2,3,4,7,8,9,10-octahydropyridazino[1,2-a]diazepine-4-carboxylic acid;3-nitrooxypropyl 7-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-6-oxo-1,2,3,4,7,8,9,10-octahydropyridazino[1,2-a]diazepine-4-carboxylate
• SMILES: CCOC(=O)C(CCc1ccccc1)NC1CCCN2CCCC(C(=O)OCCCCCO[N+](=O)[O-])N2C1=O.CCOC(=O)C(CCc1ccccc1)NC1CCCN2CCCC(C(=O)OCCCCO[N+](=O)[O-])N2C1=O.CCOC(=O)C(CCc1ccccc1)NC1CCCN2CCCC(C(=O)OCCCO[N+](=O)[O-])N2C1=O.CCOC(=O)C(CCc1ccccc1)NC1CCCN2CCCC(C(=O)OCCOCCO[N+](=O)[O-])N2C1=O.CCOC(=O)C(CCc1ccccc1)NC1CCCN2CCCC(C(=O)OCCSCCO[N+](=O)[O-])N2C1=O.O=C(OCCCO[N+](=O)[O-])C(CCc1ccccc1)NC1CCCN2CCCC(C(=O)O)N2C1=O
• InChI: InChI=1S/C27H40N4O8.C26H38N4O9.C26H38N4O8S.C26H38N4O8.C25H36N4O8.C23H32N4O8/c1-2-37-26(33)23(16-15-21-11-5-3-6-12-21)28-22-13-9-17-29-18-10-14-24(30(29)25(22)32)27(34)38-19-7-4-8-20-39-31(35)36;1-2-37-25(32)22(13-12-20-8-4-3-5-9-20)27-21-10-6-14-28-15-7-11-23(29(28)24(21)31)26(33)38-18-16-36-17-19-39-30(34)35;1-2-36-25(32)22(13-12-20-8-4-3-5-9-20)27-21-10-6-14-28-15-7-11-23(29(28)24(21)31)26(33)37-16-18-39-19-17-38-30(34)35;1-2-36-25(32)22(15-14-20-10-4-3-5-11-20)27-21-12-8-16-28-17-9-13-23(29(28)24(21)31)26(33)37-18-6-7-19-38-30(34)35;1-2-35-24(31)21(14-13-19-9-4-3-5-10-19)26-20-11-6-15-27-16-7-12-22(28(27)23(20)30)25(32)36-17-8-18-37-29(33)34;28-21-18(9-4-13-25-14-5-10-20(22(29)30)26(21)25)24-19(12-11-17-7-2-1-3-8-17)23(31)34-15-6-16-35-27(32)33/h3,5-6,11-12,22-24,28H,2,4,7-10,13-20H2,1H3;2*3-5,8-9,21-23,27H,2,6-7,10-19H2,1H3;3-5,10-11,21-23,27H,2,6-9,12-19H2,1H3;3-5,9-10,20-22,26H,2,6-8,11-18H2,1H3;1-3,7-8,18-20,24H,4-6,9-16H2,(H,29,30)
• InChIKey: NAXSKECNIQRANI-UHFFFAOYSA-N
• XLogP: 10.58
• TPSA: 863.53 Ų
• H-Bond Donors: 7
• H-Bond Acceptors: 61
• Rotatable Bonds: 84
• Heavy Atoms: 227
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	3213.64
LogP ≤ 5	10.58
H-Bond Donors ≤ 5	7
H-Bond Acceptors ≤ 10	61

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 4-nitrooxybutyl 7-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-6-oxo-1,2,3,4,7,8,9,10-octahydropyridazino[1,2-a]diazepine-4-carboxylate;2-(2-nitrooxyethoxy)ethyl 7-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-6-oxo-1,2,3,4,7,8,9,10-octahydropyridazino[1,2-a]diazepine-4-carboxylate;2-(2-nitrooxyethylsulfanyl)ethyl 7-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-6-oxo-1,2,3,4,7,8,9,10-octahydropyridazino[1,2-a]diazepine-4-carboxylate;5-nitrooxypentyl 7-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-6-oxo-1,2,3,4,7,8,9,10-octahydropyridazino[1,2-a]diazepine-4-carboxylate;7-[[1-(3-nitrooxypropoxy)-1-oxo-4-phenylbutan-2-yl]amino]-6-oxo-1,2,3,4,7,8,9,10-octahydropyridazino[1,2-a]diazepine-4-carboxylic acid;3-nitrooxypropyl 7-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-6-oxo-1,2,3,4,7,8,9,10-octahydropyridazino[1,2-a]diazepine-4-carboxylate?

The IUPAC name of 4-nitrooxybutyl 7-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-6-oxo-1,2,3,4,7,8,9,10-octahydropyridazino[1,2-a]diazepine-4-carboxylate;2-(2-nitrooxyethoxy)ethyl 7-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-6-oxo-1,2,3,4,7,8,9,10-octahydropyridazino[1,2-a]diazepine-4-carboxylate;2-(2-nitrooxyethylsulfanyl)ethyl 7-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-6-oxo-1,2,3,4,7,8,9,10-octahydropyridazino[1,2-a]diazepine-4-carboxylate;5-nitrooxypentyl 7-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-6-oxo-1,2,3,4,7,8,9,10-octahydropyridazino[1,2-a]diazepine-4-carboxylate;7-[[1-(3-nitrooxypropoxy)-1-oxo-4-phenylbutan-2-yl]amino]-6-oxo-1,2,3,4,7,8,9,10-octahydropyridazino[1,2-a]diazepine-4-carboxylic acid;3-nitrooxypropyl 7-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-6-oxo-1,2,3,4,7,8,9,10-octahydropyridazino[1,2-a]diazepine-4-carboxylate (CID 159728444) is 4-nitrooxybutyl 7-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-6-oxo-1,2,3,4,7,8,9,10-octahydropyridazino[1,2-a]diazepine-4-carboxylate;2-(2-nitrooxyethoxy)ethyl 7-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-6-oxo-1,2,3,4,7,8,9,10-octahydropyridazino[1,2-a]diazepine-4-carboxylate;2-(2-nitrooxyethylsulfanyl)ethyl 7-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-6-oxo-1,2,3,4,7,8,9,10-octahydropyridazino[1,2-a]diazepine-4-carboxylate;5-nitrooxypentyl 7-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-6-oxo-1,2,3,4,7,8,9,10-octahydropyridazino[1,2-a]diazepine-4-carboxylate;7-[[1-(3-nitrooxypropoxy)-1-oxo-4-phenylbutan-2-yl]amino]-6-oxo-1,2,3,4,7,8,9,10-octahydropyridazino[1,2-a]diazepine-4-carboxylic acid;3-nitrooxypropyl 7-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-6-oxo-1,2,3,4,7,8,9,10-octahydropyridazino[1,2-a]diazepine-4-carboxylate.

What is the SMILES notation for 4-nitrooxybutyl 7-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-6-oxo-1,2,3,4,7,8,9,10-octahydropyridazino[1,2-a]diazepine-4-carboxylate;2-(2-nitrooxyethoxy)ethyl 7-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-6-oxo-1,2,3,4,7,8,9,10-octahydropyridazino[1,2-a]diazepine-4-carboxylate;2-(2-nitrooxyethylsulfanyl)ethyl 7-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-6-oxo-1,2,3,4,7,8,9,10-octahydropyridazino[1,2-a]diazepine-4-carboxylate;5-nitrooxypentyl 7-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-6-oxo-1,2,3,4,7,8,9,10-octahydropyridazino[1,2-a]diazepine-4-carboxylate;7-[[1-(3-nitrooxypropoxy)-1-oxo-4-phenylbutan-2-yl]amino]-6-oxo-1,2,3,4,7,8,9,10-octahydropyridazino[1,2-a]diazepine-4-carboxylic acid;3-nitrooxypropyl 7-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-6-oxo-1,2,3,4,7,8,9,10-octahydropyridazino[1,2-a]diazepine-4-carboxylate?

The canonical SMILES for 4-nitrooxybutyl 7-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-6-oxo-1,2,3,4,7,8,9,10-octahydropyridazino[1,2-a]diazepine-4-carboxylate;2-(2-nitrooxyethoxy)ethyl 7-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-6-oxo-1,2,3,4,7,8,9,10-octahydropyridazino[1,2-a]diazepine-4-carboxylate;2-(2-nitrooxyethylsulfanyl)ethyl 7-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-6-oxo-1,2,3,4,7,8,9,10-octahydropyridazino[1,2-a]diazepine-4-carboxylate;5-nitrooxypentyl 7-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-6-oxo-1,2,3,4,7,8,9,10-octahydropyridazino[1,2-a]diazepine-4-carboxylate;7-[[1-(3-nitrooxypropoxy)-1-oxo-4-phenylbutan-2-yl]amino]-6-oxo-1,2,3,4,7,8,9,10-octahydropyridazino[1,2-a]diazepine-4-carboxylic acid;3-nitrooxypropyl 7-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-6-oxo-1,2,3,4,7,8,9,10-octahydropyridazino[1,2-a]diazepine-4-carboxylate is CCOC(=O)C(CCc1ccccc1)NC1CCCN2CCCC(C(=O)OCCCCCO[N+](=O)[O-])N2C1=O.CCOC(=O)C(CCc1ccccc1)NC1CCCN2CCCC(C(=O)OCCCCO[N+](=O)[O-])N2C1=O.CCOC(=O)C(CCc1ccccc1)NC1CCCN2CCCC(C(=O)OCCCO[N+](=O)[O-])N2C1=O.CCOC(=O)C(CCc1ccccc1)NC1CCCN2CCCC(C(=O)OCCOCCO[N+](=O)[O-])N2C1=O.CCOC(=O)C(CCc1ccccc1)NC1CCCN2CCCC(C(=O)OCCSCCO[N+](=O)[O-])N2C1=O.O=C(OCCCO[N+](=O)[O-])C(CCc1ccccc1)NC1CCCN2CCCC(C(=O)O)N2C1=O.

What is the InChIKey of 4-nitrooxybutyl 7-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-6-oxo-1,2,3,4,7,8,9,10-octahydropyridazino[1,2-a]diazepine-4-carboxylate;2-(2-nitrooxyethoxy)ethyl 7-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-6-oxo-1,2,3,4,7,8,9,10-octahydropyridazino[1,2-a]diazepine-4-carboxylate;2-(2-nitrooxyethylsulfanyl)ethyl 7-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-6-oxo-1,2,3,4,7,8,9,10-octahydropyridazino[1,2-a]diazepine-4-carboxylate;5-nitrooxypentyl 7-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-6-oxo-1,2,3,4,7,8,9,10-octahydropyridazino[1,2-a]diazepine-4-carboxylate;7-[[1-(3-nitrooxypropoxy)-1-oxo-4-phenylbutan-2-yl]amino]-6-oxo-1,2,3,4,7,8,9,10-octahydropyridazino[1,2-a]diazepine-4-carboxylic acid;3-nitrooxypropyl 7-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-6-oxo-1,2,3,4,7,8,9,10-octahydropyridazino[1,2-a]diazepine-4-carboxylate?

The InChIKey is NAXSKECNIQRANI-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H40N4O8.C26H38N4O9.C26H38N4O8S.C26H38N4O8.C25H36N4O8.C23H32N4O8/c1-2-37-26(33)23(16-15-21-11-5-3-6-12-21)28-22-13-9-17-29-18-10-14-24(30(29)25(22)32)27(34)38-19-7-4-8-20-39-31(35)36;1-2-37-25(32)22(13-12-20-8-4-3-5-9-20)27-21-10-6-14-28-15-7-11-23(29(28)24(21)31)26(33)38-18-16-36-17-19-39-30(34)35;1-2-36-25(32)22(13-12-20-8-4-3-5-9-20)27-21-10-6-14-28-15-7-11-23(29(28)24(21)31)26(33)37-16-18-39-19-17-38-30(34)35;1-2-36-25(32)22(15-14-20-10-4-3-5-11-20)27-21-12-8-16-28-17-9-13-23(29(28)24(21)31)26(33)37-18-6-7-19-38-30(34)35;1-2-35-24(31)21(14-13-19-9-4-3-5-10-19)26-20-11-6-15-27-16-7-12-22(28(27)23(20)30)25(32)36-17-8-18-37-29(33)34;28-21-18(9-4-13-25-14-5-10-20(22(29)30)26(21)25)24-19(12-11-17-7-2-1-3-8-17)23(31)34-15-6-16-35-27(32)33/h3,5-6,11-12,22-24,28H,2,4,7-10,13-20H2,1H3;2*3-5,8-9,21-23,27H,2,6-7,10-19H2,1H3;3-5,10-11,21-23,27H,2,6-9,12-19H2,1H3;3-5,9-10,20-22,26H,2,6-8,11-18H2,1H3;1-3,7-8,18-20,24H,4-6,9-16H2,(H,29,30).

What are the key properties of 4-nitrooxybutyl 7-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-6-oxo-1,2,3,4,7,8,9,10-octahydropyridazino[1,2-a]diazepine-4-carboxylate;2-(2-nitrooxyethoxy)ethyl 7-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-6-oxo-1,2,3,4,7,8,9,10-octahydropyridazino[1,2-a]diazepine-4-carboxylate;2-(2-nitrooxyethylsulfanyl)ethyl 7-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-6-oxo-1,2,3,4,7,8,9,10-octahydropyridazino[1,2-a]diazepine-4-carboxylate;5-nitrooxypentyl 7-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-6-oxo-1,2,3,4,7,8,9,10-octahydropyridazino[1,2-a]diazepine-4-carboxylate;7-[[1-(3-nitrooxypropoxy)-1-oxo-4-phenylbutan-2-yl]amino]-6-oxo-1,2,3,4,7,8,9,10-octahydropyridazino[1,2-a]diazepine-4-carboxylic acid;3-nitrooxypropyl 7-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-6-oxo-1,2,3,4,7,8,9,10-octahydropyridazino[1,2-a]diazepine-4-carboxylate?

4-nitrooxybutyl 7-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-6-oxo-1,2,3,4,7,8,9,10-octahydropyridazino[1,2-a]diazepine-4-carboxylate;2-(2-nitrooxyethoxy)ethyl 7-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-6-oxo-1,2,3,4,7,8,9,10-octahydropyridazino[1,2-a]diazepine-4-carboxylate;2-(2-nitrooxyethylsulfanyl)ethyl 7-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-6-oxo-1,2,3,4,7,8,9,10-octahydropyridazino[1,2-a]diazepine-4-carboxylate;5-nitrooxypentyl 7-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-6-oxo-1,2,3,4,7,8,9,10-octahydropyridazino[1,2-a]diazepine-4-carboxylate;7-[[1-(3-nitrooxypropoxy)-1-oxo-4-phenylbutan-2-yl]amino]-6-oxo-1,2,3,4,7,8,9,10-octahydropyridazino[1,2-a]diazepine-4-carboxylic acid;3-nitrooxypropyl 7-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-6-oxo-1,2,3,4,7,8,9,10-octahydropyridazino[1,2-a]diazepine-4-carboxylate has a molecular weight of 3213.64 g/mol, XLogP of 10.58, 84 rotatable bonds, 7 hydrogen bond donors, and 61 hydrogen bond acceptors.

Where does this data come from?

All data for 4-nitrooxybutyl 7-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-6-oxo-1,2,3,4,7,8,9,10-octahydropyridazino[1,2-a]diazepine-4-carboxylate;2-(2-nitrooxyethoxy)ethyl 7-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-6-oxo-1,2,3,4,7,8,9,10-octahydropyridazino[1,2-a]diazepine-4-carboxylate;2-(2-nitrooxyethylsulfanyl)ethyl 7-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-6-oxo-1,2,3,4,7,8,9,10-octahydropyridazino[1,2-a]diazepine-4-carboxylate;5-nitrooxypentyl 7-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-6-oxo-1,2,3,4,7,8,9,10-octahydropyridazino[1,2-a]diazepine-4-carboxylate;7-[[1-(3-nitrooxypropoxy)-1-oxo-4-phenylbutan-2-yl]amino]-6-oxo-1,2,3,4,7,8,9,10-octahydropyridazino[1,2-a]diazepine-4-carboxylic acid;3-nitrooxypropyl 7-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-6-oxo-1,2,3,4,7,8,9,10-octahydropyridazino[1,2-a]diazepine-4-carboxylate is sourced from PubChem (CID 159728444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).