Basic Information |
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Product Name: | ICG-001 |
CAS: | 847591-62-2 ;780757-88-2 |
English Synonyms: | ICG-001 ; (6S,9AS)-N-BENZYL-6-[(4-HYDROXYPHENYL)METHYL]-8-(NAPHTHALEN-1-YLMETHYL)-4,7-DIOXO-TETRAHYDRO-2H-PYRIMIDO[1,2-A]PIPERAZINE-1-CARBOXAMIDE ; (6S,9AS)-N-BENZYL-6-(4-HYDROXYBENZYL)-8-(NAPHTHALEN-1-YLMETHYL)-4,7-DIOXOOCTAHYDRO-1H-PYRAZINO[1,2-A]PYRIMIDINE-1-CARBOXAMIDE ; 2H-PYRAZINO[1,2-A]PYRIMIDINE-1(6H)-CARBOXAMIDE, HEXAHYDRO-6-[(4-HYDROXYPHENYL)METHYL]-8-(1-NAPHTHALENYLMETHYL)-4,7-DIOXO-N-(PHENYLMETHYL)-, (6S,9AS)-REL- ; 2H-PYRAZINO[1,2-A]PYRIMIDINE-1(6H)-CARBOXAMIDE, HEXAHYDRO-6-[(4-HYDROXYPHENYL)METHYL]-8-(1-NAPHTHALENYLMETHYL)-4,7-DIOXO-N-(PHENYLMETHYL)-, (6S,9AS)- ; (6S,9AS)-6-(4-HYDROXYBENZYL)-8-NAPHTHALEN-1-YLMETHYL-4,7-DIOXO-HEXAHYDRO-PYRAZINO[1,2-A]PYRIMIDINE-1-CARBOXYLIC ACID BENZYLAMIDE ; (6S,9AS)-REL-N-BENZYL-6-(4-HYDROXYBENZYL)-8-(NAPHTHALEN-1-YLMETHYL)-4,7-DIOXOOCTAHYDRO-1H-PYRIMIDO[1,2-A]PYRAZINE-1-CARBOXAMIDE ; (6S,9AS)-N-BENZYL-6-(4-HYDROXYBENZYL)-8-(NAPHTHALEN-1-YLMETHYL)-4,7-DIOXOHEXAHYDRO-2H-PYRAZINO[1,2-A]PYRIMIDINE-1(6H)-CARBOXAMIDE ; (6S,9AS)-HEXAHYDRO-6-[(4-HYDROXYPHENYL)METHYL]-8-(1-NAPHTHALENYLMETHYL)-4,7-DIOXO-N-(PHENYLMETHYL)-2H-PYRAZINO[1,2-A]PYRIMIDINE-1(6H)-CARBOXAMIDE |
MDL Number.: | MFCD12196918 |
H bond acceptor: | 8 |
H bond donor: | 2 |
Smile: | c1ccc(cc1)CNC(=O)N2CCC(=O)N3[C@@H]2CN(C(=O)[C@@H]3Cc4ccc(cc4)O)Cc5cccc6c5cccc6 |
InChi: | InChI=1S/C33H32N4O4/c38-27-15-13-23(14-16-27)19-29-32(40)35(21-26-11-6-10-25-9-4-5-12-28(25)26)22-30-36(18-17-31(39)37(29)30)33(41)34-20-24-7-2-1-3-8-24/h1-16,29-30,38H,17-22H2,(H,34,41)/t29-,30+/m0/s1 |
InChiKey: | InChIKey=HQWTUOLCGKIECB-XZWHSSHBSA-N |
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