Name: Name:7-Tert-Butyl 3-Ethyl 8,9-Dihydro-5H-Imidazo[1,2-D][1,4]Diazepine-3,7(6H)-Dicarboxylate
Brand: Angene
SKU: AG00HT6Z
Rating: 90 (10 reviews)

7-Tert-Butyl 3-Ethyl 8,9-Dihydro-5H-Imidazo[1,2-D][1,4]Diazepine-3,7(6H)-Dicarboxylate

CAS No.:

1341037-28-2

Catalog Number:

AG00HT6Z

Molecular Formula:

C15H23N3O4

Molecular Weight:

309.3608

Catalog Number:

AG00HT6Z

Chemical Name:

7-Tert-Butyl 3-Ethyl 8,9-Dihydro-5H-Imidazo[1,2-D][1,4]Diazepine-3,7(6H)-Dicarboxylate

CAS Number:

1341037-28-2

Molecular Formula:

C15H23N3O4

Molecular Weight:

309.3608

MDL Number:

MFCD27997387

IUPAC Name:

7-O-tert-butyl 3-O-ethyl 5,6,8,9-tetrahydroimidazo[1,2-d][1,4]diazepine-3,7-dicarboxylate

InChI:

InChI=1S/C15H23N3O4/c1-5-21-13(19)11-10-16-12-6-7-17(8-9-18(11)12)14(20)22-15(2,3)4/h10H,5-9H2,1-4H3

InChI Key:

NNBCUGSHQIGJSO-UHFFFAOYSA-N

SMILES:

CCOC(=O)c1cnc2n1CCN(CC2)C(=O)OC(C)(C)C

Complexity:

422

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

309.169g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

309.366g/mol

Monoisotopic Mass:

309.169g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

73.7A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.5