About (2S,3R)-3-[(2-amino-4-pyridinyl)methyl]-1-N-[(1R)-1-(3-chlorophenyl)propyl]-1-N,2-N-dimethyl-4-oxo-2-N-pyridin-4-ylazetidine-1,2-dicarboxamide;(2S,3R)-3-[[2-[bis[(4-methoxyphenyl)methyl]amino]-4-pyridinyl]methyl]-1-[[(1R)-1-(3-chlorophenyl)propyl]carbamoyl]-4-oxoazetidine-2-carboxylic acid;(2S,3R)-3-[[2-[bis[(4-methoxyphenyl)methyl]amino]-4-pyridinyl]methyl]-1-N-[(1R)-1-(3-chlorophenyl)propyl]-1-N,2-N-dimethyl-4-oxo-2-N-pyridin-4-ylazetidine-1,2-dicarboxamide;(2S,3R)-3-[[2-[bis[(4-methoxyphenyl)methyl]amino]-4-pyridinyl]methyl]-1-N-[(1R)-1-(3-chlorophenyl)propyl]-2-N-methyl-4-oxo-2-N-pyridin-4-ylazetidine-1,2-dicarboxamide;(2S,3R)-3-[[2-[bis[(4-methoxyphenyl)methyl]amino]-4-pyridinyl]methyl]-4-oxoazetidine-2-carboxylic acid;1-chloro-3-[(1R)-1-isocyanatopropyl]benzene
(2S,3R)-3-[(2-amino-4-pyridinyl)methyl]-1-N-[(1R)-1-(3-chlorophenyl)propyl]-1-N,2-N-dimethyl-4-oxo-2-N-pyridin-4-ylazetidine-1,2-dicarboxamide;(2S,3R)-3-[[2-[bis[(4-methoxyphenyl)methyl]amino]-4-pyridinyl]methyl]-1-[[(1R)-1-(3-chlorophenyl)propyl]carbamoyl]-4-oxoazetidine-2-carboxylic acid;(2S,3R)-3-[[2-[bis[(4-methoxyphenyl)methyl]amino]-4-pyridinyl]methyl]-1-N-[(1R)-1-(3-chlorophenyl)propyl]-1-N,2-N-dimethyl-4-oxo-2-N-pyridin-4-ylazetidine-1,2-dicarboxamide;(2S,3R)-3-[[2-[bis[(4-methoxyphenyl)methyl]amino]-4-pyridinyl]methyl]-1-N-[(1R)-1-(3-chlorophenyl)propyl]-2-N-methyl-4-oxo-2-N-pyridin-4-ylazetidine-1,2-dicarboxamide;(2S,3R)-3-[[2-[bis[(4-methoxyphenyl)methyl]amino]-4-pyridinyl]methyl]-4-oxoazetidine-2-carboxylic acid;1-chloro-3-[(1R)-1-isocyanatopropyl]benzene (PubChem CID 158665420) has the molecular formula C184H191Cl5N26O25
and a molecular weight of 3343.97 g/mol. Its IUPAC name is (2S,3R)-3-[(2-amino-4-pyridinyl)methyl]-1-N-[(1R)-1-(3-chlorophenyl)propyl]-1-N,2-N-dimethyl-4-oxo-2-N-pyridin-4-ylazetidine-1,2-dicarboxamide;(2S,3R)-3-[[2-[bis[(4-methoxyphenyl)methyl]amino]-4-pyridinyl]methyl]-1-[[(1R)-1-(3-chlorophenyl)propyl]carbamoyl]-4-oxoazetidine-2-carboxylic acid;(2S,3R)-3-[[2-[bis[(4-methoxyphenyl)methyl]amino]-4-pyridinyl]methyl]-1-N-[(1R)-1-(3-chlorophenyl)propyl]-1-N,2-N-dimethyl-4-oxo-2-N-pyridin-4-ylazetidine-1,2-dicarboxamide;(2S,3R)-3-[[2-[bis[(4-methoxyphenyl)methyl]amino]-4-pyridinyl]methyl]-1-N-[(1R)-1-(3-chlorophenyl)propyl]-2-N-methyl-4-oxo-2-N-pyridin-4-ylazetidine-1,2-dicarboxamide;(2S,3R)-3-[[2-[bis[(4-methoxyphenyl)methyl]amino]-4-pyridinyl]methyl]-4-oxoazetidine-2-carboxylic acid;1-chloro-3-[(1R)-1-isocyanatopropyl]benzene.
Frequently Asked Questions
What is the IUPAC name of (2S,3R)-3-[(2-amino-4-pyridinyl)methyl]-1-N-[(1R)-1-(3-chlorophenyl)propyl]-1-N,2-N-dimethyl-4-oxo-2-N-pyridin-4-ylazetidine-1,2-dicarboxamide;(2S,3R)-3-[[2-[bis[(4-methoxyphenyl)methyl]amino]-4-pyridinyl]methyl]-1-[[(1R)-1-(3-chlorophenyl)propyl]carbamoyl]-4-oxoazetidine-2-carboxylic acid;(2S,3R)-3-[[2-[bis[(4-methoxyphenyl)methyl]amino]-4-pyridinyl]methyl]-1-N-[(1R)-1-(3-chlorophenyl)propyl]-1-N,2-N-dimethyl-4-oxo-2-N-pyridin-4-ylazetidine-1,2-dicarboxamide;(2S,3R)-3-[[2-[bis[(4-methoxyphenyl)methyl]amino]-4-pyridinyl]methyl]-1-N-[(1R)-1-(3-chlorophenyl)propyl]-2-N-methyl-4-oxo-2-N-pyridin-4-ylazetidine-1,2-dicarboxamide;(2S,3R)-3-[[2-[bis[(4-methoxyphenyl)methyl]amino]-4-pyridinyl]methyl]-4-oxoazetidine-2-carboxylic acid;1-chloro-3-[(1R)-1-isocyanatopropyl]benzene?
The IUPAC name of (2S,3R)-3-[(2-amino-4-pyridinyl)methyl]-1-N-[(1R)-1-(3-chlorophenyl)propyl]-1-N,2-N-dimethyl-4-oxo-2-N-pyridin-4-ylazetidine-1,2-dicarboxamide;(2S,3R)-3-[[2-[bis[(4-methoxyphenyl)methyl]amino]-4-pyridinyl]methyl]-1-[[(1R)-1-(3-chlorophenyl)propyl]carbamoyl]-4-oxoazetidine-2-carboxylic acid;(2S,3R)-3-[[2-[bis[(4-methoxyphenyl)methyl]amino]-4-pyridinyl]methyl]-1-N-[(1R)-1-(3-chlorophenyl)propyl]-1-N,2-N-dimethyl-4-oxo-2-N-pyridin-4-ylazetidine-1,2-dicarboxamide;(2S,3R)-3-[[2-[bis[(4-methoxyphenyl)methyl]amino]-4-pyridinyl]methyl]-1-N-[(1R)-1-(3-chlorophenyl)propyl]-2-N-methyl-4-oxo-2-N-pyridin-4-ylazetidine-1,2-dicarboxamide;(2S,3R)-3-[[2-[bis[(4-methoxyphenyl)methyl]amino]-4-pyridinyl]methyl]-4-oxoazetidine-2-carboxylic acid;1-chloro-3-[(1R)-1-isocyanatopropyl]benzene (CID 158665420) is (2S,3R)-3-[(2-amino-4-pyridinyl)methyl]-1-N-[(1R)-1-(3-chlorophenyl)propyl]-1-N,2-N-dimethyl-4-oxo-2-N-pyridin-4-ylazetidine-1,2-dicarboxamide;(2S,3R)-3-[[2-[bis[(4-methoxyphenyl)methyl]amino]-4-pyridinyl]methyl]-1-[[(1R)-1-(3-chlorophenyl)propyl]carbamoyl]-4-oxoazetidine-2-carboxylic acid;(2S,3R)-3-[[2-[bis[(4-methoxyphenyl)methyl]amino]-4-pyridinyl]methyl]-1-N-[(1R)-1-(3-chlorophenyl)propyl]-1-N,2-N-dimethyl-4-oxo-2-N-pyridin-4-ylazetidine-1,2-dicarboxamide;(2S,3R)-3-[[2-[bis[(4-methoxyphenyl)methyl]amino]-4-pyridinyl]methyl]-1-N-[(1R)-1-(3-chlorophenyl)propyl]-2-N-methyl-4-oxo-2-N-pyridin-4-ylazetidine-1,2-dicarboxamide;(2S,3R)-3-[[2-[bis[(4-methoxyphenyl)methyl]amino]-4-pyridinyl]methyl]-4-oxoazetidine-2-carboxylic acid;1-chloro-3-[(1R)-1-isocyanatopropyl]benzene.
What is the SMILES notation for (2S,3R)-3-[(2-amino-4-pyridinyl)methyl]-1-N-[(1R)-1-(3-chlorophenyl)propyl]-1-N,2-N-dimethyl-4-oxo-2-N-pyridin-4-ylazetidine-1,2-dicarboxamide;(2S,3R)-3-[[2-[bis[(4-methoxyphenyl)methyl]amino]-4-pyridinyl]methyl]-1-[[(1R)-1-(3-chlorophenyl)propyl]carbamoyl]-4-oxoazetidine-2-carboxylic acid;(2S,3R)-3-[[2-[bis[(4-methoxyphenyl)methyl]amino]-4-pyridinyl]methyl]-1-N-[(1R)-1-(3-chlorophenyl)propyl]-1-N,2-N-dimethyl-4-oxo-2-N-pyridin-4-ylazetidine-1,2-dicarboxamide;(2S,3R)-3-[[2-[bis[(4-methoxyphenyl)methyl]amino]-4-pyridinyl]methyl]-1-N-[(1R)-1-(3-chlorophenyl)propyl]-2-N-methyl-4-oxo-2-N-pyridin-4-ylazetidine-1,2-dicarboxamide;(2S,3R)-3-[[2-[bis[(4-methoxyphenyl)methyl]amino]-4-pyridinyl]methyl]-4-oxoazetidine-2-carboxylic acid;1-chloro-3-[(1R)-1-isocyanatopropyl]benzene?
The canonical SMILES for (2S,3R)-3-[(2-amino-4-pyridinyl)methyl]-1-N-[(1R)-1-(3-chlorophenyl)propyl]-1-N,2-N-dimethyl-4-oxo-2-N-pyridin-4-ylazetidine-1,2-dicarboxamide;(2S,3R)-3-[[2-[bis[(4-methoxyphenyl)methyl]amino]-4-pyridinyl]methyl]-1-[[(1R)-1-(3-chlorophenyl)propyl]carbamoyl]-4-oxoazetidine-2-carboxylic acid;(2S,3R)-3-[[2-[bis[(4-methoxyphenyl)methyl]amino]-4-pyridinyl]methyl]-1-N-[(1R)-1-(3-chlorophenyl)propyl]-1-N,2-N-dimethyl-4-oxo-2-N-pyridin-4-ylazetidine-1,2-dicarboxamide;(2S,3R)-3-[[2-[bis[(4-methoxyphenyl)methyl]amino]-4-pyridinyl]methyl]-1-N-[(1R)-1-(3-chlorophenyl)propyl]-2-N-methyl-4-oxo-2-N-pyridin-4-ylazetidine-1,2-dicarboxamide;(2S,3R)-3-[[2-[bis[(4-methoxyphenyl)methyl]amino]-4-pyridinyl]methyl]-4-oxoazetidine-2-carboxylic acid;1-chloro-3-[(1R)-1-isocyanatopropyl]benzene is CC[C@@H](N=C=O)c1cccc(Cl)c1.CC[C@@H](NC(=O)N1C(=O)[C@H](Cc2ccnc(N(Cc3ccc(OC)cc3)Cc3ccc(OC)cc3)c2)[C@H]1C(=O)N(C)c1ccncc1)c1cccc(Cl)c1.CC[C@@H](NC(=O)N1C(=O)[C@H](Cc2ccnc(N(Cc3ccc(OC)cc3)Cc3ccc(OC)cc3)c2)[C@H]1C(=O)O)c1cccc(Cl)c1.CC[C@H](c1cccc(Cl)c1)N(C)C(=O)N1C(=O)[C@H](Cc2ccnc(N(Cc3ccc(OC)cc3)Cc3ccc(OC)cc3)c2)[C@H]1C(=O)N(C)c1ccncc1.CC[C@H](c1cccc(Cl)c1)N(C)C(=O)N1C(=O)[C@H](Cc2ccnc(N)c2)[C@H]1C(=O)N(C)c1ccncc1.COc1ccc(CN(Cc2ccc(OC)cc2)c2cc(C[C@H]3C(=O)N[C@@H]3C(=O)O)ccn2)cc1.
What is the InChIKey of (2S,3R)-3-[(2-amino-4-pyridinyl)methyl]-1-N-[(1R)-1-(3-chlorophenyl)propyl]-1-N,2-N-dimethyl-4-oxo-2-N-pyridin-4-ylazetidine-1,2-dicarboxamide;(2S,3R)-3-[[2-[bis[(4-methoxyphenyl)methyl]amino]-4-pyridinyl]methyl]-1-[[(1R)-1-(3-chlorophenyl)propyl]carbamoyl]-4-oxoazetidine-2-carboxylic acid;(2S,3R)-3-[[2-[bis[(4-methoxyphenyl)methyl]amino]-4-pyridinyl]methyl]-1-N-[(1R)-1-(3-chlorophenyl)propyl]-1-N,2-N-dimethyl-4-oxo-2-N-pyridin-4-ylazetidine-1,2-dicarboxamide;(2S,3R)-3-[[2-[bis[(4-methoxyphenyl)methyl]amino]-4-pyridinyl]methyl]-1-N-[(1R)-1-(3-chlorophenyl)propyl]-2-N-methyl-4-oxo-2-N-pyridin-4-ylazetidine-1,2-dicarboxamide;(2S,3R)-3-[[2-[bis[(4-methoxyphenyl)methyl]amino]-4-pyridinyl]methyl]-4-oxoazetidine-2-carboxylic acid;1-chloro-3-[(1R)-1-isocyanatopropyl]benzene?
The InChIKey is IDHDEUDQQXYGAO-ULLLWGCPSA-N. The full InChI is InChI=1S/C43H45ClN6O5.C42H43ClN6O5.C36H37ClN4O6.C27H29ClN6O3.C26H27N3O5.C10H10ClNO/c1-6-38(32-8-7-9-33(44)26-32)48(3)43(53)50-40(42(52)47(2)34-19-21-45-22-20-34)37(41(50)51)24-31-18-23-46-39(25-31)49(27-29-10-14-35(54-4)15-11-29)28-30-12-16-36(55-5)17-13-30;1-5-37(31-7-6-8-32(43)25-31)46-42(52)49-39(41(51)47(2)33-18-20-44-21-19-33)36(40(49)50)23-30-17-22-45-38(24-30)48(26-28-9-13-34(53-3)14-10-28)27-29-11-15-35(54-4)16-12-29;1-4-31(26-6-5-7-27(37)20-26)39-36(45)41-33(35(43)44)30(34(41)42)18-25-16-17-38-32(19-25)40(21-23-8-12-28(46-2)13-9-23)22-24-10-14-29(47-3)15-11-24;1-4-22(18-6-5-7-19(28)16-18)33(3)27(37)34-24(26(36)32(2)20-9-11-30-12-10-20)21(25(34)35)14-17-8-13-31-23(29)15-17;1-33-20-7-3-17(4-8-20)15-29(16-18-5-9-21(34-2)10-6-18)23-14-19(11-12-27-23)13-22-24(26(31)32)28-25(22)30;1-2-10(12-7-13)8-4-3-5-9(11)6-8/h7-23,25-26,37-38,40H,6,24,27-28H2,1-5H3;6-22,24-25,36-37,39H,5,23,26-27H2,1-4H3,(H,46,52);5-17,19-20,30-31,33H,4,18,21-22H2,1-3H3,(H,39,45)(H,43,44);5-13,15-16,21-22,24H,4,14H2,1-3H3,(H2,29,31);3-12,14,22,24H,13,15-16H2,1-2H3,(H,28,30)(H,31,32);3-6,10H,2H2,1H3/t37-,38-,40+;36-,37-,39+;30-,31-,33+;21-,22-,24+;22-,24+;10-/m111111/s1.
What are the key properties of (2S,3R)-3-[(2-amino-4-pyridinyl)methyl]-1-N-[(1R)-1-(3-chlorophenyl)propyl]-1-N,2-N-dimethyl-4-oxo-2-N-pyridin-4-ylazetidine-1,2-dicarboxamide;(2S,3R)-3-[[2-[bis[(4-methoxyphenyl)methyl]amino]-4-pyridinyl]methyl]-1-[[(1R)-1-(3-chlorophenyl)propyl]carbamoyl]-4-oxoazetidine-2-carboxylic acid;(2S,3R)-3-[[2-[bis[(4-methoxyphenyl)methyl]amino]-4-pyridinyl]methyl]-1-N-[(1R)-1-(3-chlorophenyl)propyl]-1-N,2-N-dimethyl-4-oxo-2-N-pyridin-4-ylazetidine-1,2-dicarboxamide;(2S,3R)-3-[[2-[bis[(4-methoxyphenyl)methyl]amino]-4-pyridinyl]methyl]-1-N-[(1R)-1-(3-chlorophenyl)propyl]-2-N-methyl-4-oxo-2-N-pyridin-4-ylazetidine-1,2-dicarboxamide;(2S,3R)-3-[[2-[bis[(4-methoxyphenyl)methyl]amino]-4-pyridinyl]methyl]-4-oxoazetidine-2-carboxylic acid;1-chloro-3-[(1R)-1-isocyanatopropyl]benzene?
(2S,3R)-3-[(2-amino-4-pyridinyl)methyl]-1-N-[(1R)-1-(3-chlorophenyl)propyl]-1-N,2-N-dimethyl-4-oxo-2-N-pyridin-4-ylazetidine-1,2-dicarboxamide;(2S,3R)-3-[[2-[bis[(4-methoxyphenyl)methyl]amino]-4-pyridinyl]methyl]-1-[[(1R)-1-(3-chlorophenyl)propyl]carbamoyl]-4-oxoazetidine-2-carboxylic acid;(2S,3R)-3-[[2-[bis[(4-methoxyphenyl)methyl]amino]-4-pyridinyl]methyl]-1-N-[(1R)-1-(3-chlorophenyl)propyl]-1-N,2-N-dimethyl-4-oxo-2-N-pyridin-4-ylazetidine-1,2-dicarboxamide;(2S,3R)-3-[[2-[bis[(4-methoxyphenyl)methyl]amino]-4-pyridinyl]methyl]-1-N-[(1R)-1-(3-chlorophenyl)propyl]-2-N-methyl-4-oxo-2-N-pyridin-4-ylazetidine-1,2-dicarboxamide;(2S,3R)-3-[[2-[bis[(4-methoxyphenyl)methyl]amino]-4-pyridinyl]methyl]-4-oxoazetidine-2-carboxylic acid;1-chloro-3-[(1R)-1-isocyanatopropyl]benzene has a molecular weight of 3343.97 g/mol, XLogP of 31.23, 61 rotatable bonds, 6 hydrogen bond donors, and 37 hydrogen bond acceptors.
Where does this data come from?
All data for (2S,3R)-3-[(2-amino-4-pyridinyl)methyl]-1-N-[(1R)-1-(3-chlorophenyl)propyl]-1-N,2-N-dimethyl-4-oxo-2-N-pyridin-4-ylazetidine-1,2-dicarboxamide;(2S,3R)-3-[[2-[bis[(4-methoxyphenyl)methyl]amino]-4-pyridinyl]methyl]-1-[[(1R)-1-(3-chlorophenyl)propyl]carbamoyl]-4-oxoazetidine-2-carboxylic acid;(2S,3R)-3-[[2-[bis[(4-methoxyphenyl)methyl]amino]-4-pyridinyl]methyl]-1-N-[(1R)-1-(3-chlorophenyl)propyl]-1-N,2-N-dimethyl-4-oxo-2-N-pyridin-4-ylazetidine-1,2-dicarboxamide;(2S,3R)-3-[[2-[bis[(4-methoxyphenyl)methyl]amino]-4-pyridinyl]methyl]-1-N-[(1R)-1-(3-chlorophenyl)propyl]-2-N-methyl-4-oxo-2-N-pyridin-4-ylazetidine-1,2-dicarboxamide;(2S,3R)-3-[[2-[bis[(4-methoxyphenyl)methyl]amino]-4-pyridinyl]methyl]-4-oxoazetidine-2-carboxylic acid;1-chloro-3-[(1R)-1-isocyanatopropyl]benzene is sourced from PubChem (CID 158665420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).