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Home > Nitro Compounds > 77220-80-5
77220-80-5 | N-T-BOC-O-BENZYL-SER-GLY-ARG P-NITROANILIDE
CAS No: 77220-80-5 Catalog No: AG00G6Z9 MDL No:
Product Description
Catalog Number:
AG00G6Z9
Chemical Name:
N-T-BOC-O-BENZYL-SER-GLY-ARG P-NITROANILIDE
CAS Number:
77220-80-5
IUPAC Name:
tert-butyl N-[1-[[2-[[5-(diaminomethylideneamino)-1-(4-nitroanilino)-1-oxopentan-2-yl]amino]-2-oxoethyl]amino]-1-oxo-3-phenylmethoxypropan-2-yl]carbamate
InChI:
InChI=1S/C29H40N8O8/c1-29(2,3)45-28(41)36-23(18-44-17-19-8-5-4-6-9-19)25(39)33-16-24(38)35-22(10-7-15-32-27(30)31)26(40)34-20-11-13-21(14-12-20)37(42)43/h4-6,8-9,11-14,22-23H,7,10,15-18H2,1-3H3,(H,33,39)(H,34,40)(H,35,38)(H,36,41)(H4,30,31,32)
InChI Key:
VVLVMZUTZYDQNL-UHFFFAOYSA-N
Properties
Complexity:
1010
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
628.297g/mol
Formal Charge:
0
Heavy Atom Count:
45
Hydrogen Bond Acceptor Count:
9
Hydrogen Bond Donor Count:
6
Isotope Atom Count:
0
Molecular Weight:
628.687g/mol
Monoisotopic Mass:
628.297g/mol
Rotatable Bond Count:
17
Topological Polar Surface Area:
245A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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