ETHYL N2-[3-[BIS(2-CHLOROETHYL)AMINO]-N-(4-FLUORO-3-PHENYL-L-ALANYL)-3-PHENYL-L-ALANYL]-L-ASPARAGINATE MONOHYDROCHLORIDE

CAS No.
35849-45-7
CCD No.
CCD00821671
Formula
C28 H36 Cl2 F N5 O5 . Cl H
MolWeight
648.987

Basic Information

Product Name: ETHYL N2-[3-[BIS(2-CHLOROETHYL)AMINO]-N-(4-FLUORO-3-PHENYL-L-ALANYL)-3-PHENYL-L-ALANYL]-L-ASPARAGINATE MONOHYDROCHLORIDE
CAS: 35849-45-7
English Synonyms: ETHYL N2-[3-[BIS(2-CHLOROETHYL)AMINO]-N-(4-FLUORO-3-PHENYL-L-ALANYL)-3-PHENYL-L-ALANYL]-L-ASPARAGINATE MONOHYDROCHLORIDE
MDL Number.: MFCD09838469
H bond acceptor: 10
H bond donor: 4
Smile: CCOC(=O)[C@H](CC(=O)N)NC(=O)[C@H](Cc1cccc(c1)N(CCCl)CCCl)NC(=O)[C@H](Cc2ccc(cc2)F)N.Cl
InChi: InChI=1S/C28H36Cl2FN5O5.ClH/c1-2-41-28(40)24(17-25(33)37)35-27(39)23(34-26(38)22(32)15-18-6-8-20(31)9-7-18)16-19-4-3-5-21(14-19)36(12-10-29)13-11-30;/h3-9,14,22-24H,2,10-13,15-17,32H2,1H3,(H2,33,37)(H,34,38)(H,35,39);1H/t22-,23-,24-;/m0./s1
InChiKey: InChIKey=KQDWIRYDDBDYQX-NYTZCTPBSA-N

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