200,000+ products from a single source!
sales@angenechem.com
121635-59-4 | 1H-1,5-Benzodiazepine-2-carboxylic acid, 5-[2-[bis(2-methylpropyl)amino]acetyl]-2,3,4,5-tetrahydro-4-methyl-, ethyl ester
CAS No: 121635-59-4 Catalog No: AG0015GK MDL No:
Product Description
Catalog Number:
AG0015GK
Chemical Name:
1H-1,5-Benzodiazepine-2-carboxylic acid, 5-[2-[bis(2-methylpropyl)amino]acetyl]-2,3,4,5-tetrahydro-4-methyl-, ethyl ester
CAS Number:
121635-59-4
Molecular Formula:
C23H37N3O3
Molecular Weight:
403.5582
IUPAC Name:
ethyl 5-[2-[bis(2-methylpropyl)amino]acetyl]-4-methyl-1,2,3,4-tetrahydro-1,5-benzodiazepine-2-carboxylate
InChI:
InChI=1S/C23H37N3O3/c1-7-29-23(28)20-12-18(6)26(21-11-9-8-10-19(21)24-20)22(27)15-25(13-16(2)3)14-17(4)5/h8-11,16-18,20,24H,7,12-15H2,1-6H3
InChI Key:
RZNPOPWSJIJUPY-UHFFFAOYSA-N
SMILES:
CCOC(=O)C1CC(C)N(c2c(N1)cccc2)C(=O)CN(CC(C)C)CC(C)C
Properties
Complexity:
528
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
403.283g/mol
Formal Charge:
0
Heavy Atom Count:
29
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
403.567g/mol
Monoisotopic Mass:
403.283g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
61.9A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
4.9
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.