(3aR,4S,8aS,8bS)-2-benzyl-5''-chloro-7''-methyl-spiro[3a,6,7,8,8a,8b-hexahydropyrrolo[3,4-a]pyrrolizine-4,3''-indoline]-1,2'',3-trione
概要:(3aR,4S,8aS,8bS)-2-benzyl-5''-chloro-7''-methyl-spiro[3a,6,7,8,8a,8b-hexahydropyrrolo[3,4-a]pyrrolizine-4,3''-indoline]-1,2'',3-trione(CAS 958938-25-5)是一种化学化合物,分子式为C24H22ClN3O3,分子量为435.13 g/mol。河南科弘生物科技有限公司提供CRO/CDMO定制合成服务,支持克级到吨级规格。
(3S,3'aR,8'aS,8'bS)-2'-benzyl-5-chloro-7-methylspiro[1H-indole-3,4'-3a,6,7,8,8a,8b-hexahydropyrrolo[3,4-a]pyrrolizine]-1',2,3'-trione
又称:(3aR,4S,8aS,8bS)-2-benzyl-5''-chloro-7''-methyl-spiro[3a,6,7,8,8a,8b-hexahydropyrrolo[3,4-a]pyrrolizine-4,3''-indoline]-1,2'',3-trione, (3S,3''aR,8''aS,8''bS)-2''-benzyl-5-chloro-7-methylspiro[1H-indole-3,4''-3a,6,7,8,8a,8b-hexahydropyrrolo[3,4-a]pyrrolizine]-1'',2,3''-trione, (3S,3''aR,8''aS,8''bS)-5-chloranyl-7-methyl-2''-(phenylmethyl)spiro[1H-indole-3,4''-3a,6,7,8,8a,8b-hexahydropyrrolo[3,4-a]pyrrolizine]-1'',2,3''-trione, (3S,3''aR,8''aS,8''bS)-5-chloro-7-methyl-2''-(phenylmethyl)spiro[1H-indole-3,4''-3a,6,7,8,8a,8b-hexahydropyrrolo[3,4-a]pyrrolizine]-1'',2,3''-trione, (3S,3'aR,8'aS,8'bS)-2'-benzyl-5-chloro-7-methylspiro[1H-indole-3,4'-3a,6,7,8,8a,8b-hexahydropyrrolo[3,4-a]pyrrolizine]-1',2,3'-trione
| 分子式 | C24H22ClN3O3 |
|---|---|
| 分子量 | 435.13 g/mol |
| LogP | 3.07522 |
| 拓扑极性表面积 | 69.72 Ų |
| 氢键供体数 | 1 |
| 氢键受体数 | 4 |
| 可旋转键数 | 2 |
| 精确质量 | 435.13498 |
| 重原子数 | 31 |
| 复杂度 | 1150.2585 |
化学标识符
| CAS 编号 | 958938-25-5 |
|---|---|
| SMILES | CC1=CC(=CC2=C1NC(=O)[C@]23[C@H]4[C@@H]([C@H]5N3CCC5)C(=O)N(C4=O)CC6=CC=CC=C6)Cl |
产品概述
(3aR,4S,8aS,8bS)-2-benzyl-5''-chloro-7''-methyl-spiro[3a,6,7,8,8a,8b-hexahydropyrrolo[3,4-a]pyrrolizine-4,3''-indoline]-1,2'',3-trione(CAS 958938-25-5),分子式为C24H22ClN3O3,分子量为435.13 g/mol。IUPAC名:(3S,3'aR,8'aS,8'bS)-2'-benzyl-5-chloro-7-methylspiro[1H-indole-3,4'-3a,6,7,8,8a,8b-hexahydropyrrolo[3,4-a]pyrrolizine]-1',2,3'-trione。
(3aR,4S,8aS,8bS)-2-benzyl-5''-chloro-7''-methyl-spiro[3a,6,7,8,8a,8b-hexahydropyrrolo[3,4-a]pyrrolizine-4,3''-indoline]-1,2'',3-trione化学性质概览
属性洞察:(3aR,4S,8aS,8bS)-2-benzyl-5''-chloro-7''-methyl-spiro[3a,6,7,8,8a,8b-hexahydropyrrolo[3,4-a]pyrrolizine-4,3''-indoline]-1,2'',3-trione
(3aR,4S,8aS,8bS)-2-benzyl-5''-chloro-7''-methyl-spiro[3a,6,7,8,8a,8b-hexahydropyrrolo[3,4-a]pyrrolizine-4,3''-indoline]-1,2'',3-trione的XLogP值为3.07522,表明该化合物具有亲脂性(脂溶性好),可能影响其吸收、分布和配方策略。 TPSA为69.72 Ų,处于中等极性范围,在透过性和溶解性之间取得平衡。 根据Lipinski五规则,(3aR,4S,8aS,8bS)-2-benzyl-5''-chloro-7''-methyl-spiro[3a,6,7,8,8a,8b-hexahydropyrrolo[3,4-a]pyrrolizine-4,3''-indoline]-1,2'',3-trione有1个氢键供体和4个氢键受体,均在类药范围内,提示具有较好的口服生物利用度潜力。
常见问题
常见问题
(3aR,4S,8aS,8bS)-2-benzyl-5''-chloro-7''-methyl-spiro[3a,6,7,8,8a,8b-hexahydropyrrolo[3,4-a]pyrrolizine-4,3''-indoline]-1,2'',3-trione的CAS号是多少?
(3aR,4S,8aS,8bS)-2-benzyl-5''-chloro-7''-methyl-spiro[3a,6,7,8,8a,8b-hexahydropyrrolo[3,4-a]pyrrolizine-4,3''-indoline]-1,2'',3-trione的CAS号为958938-25-5。
(3aR,4S,8aS,8bS)-2-benzyl-5''-chloro-7''-methyl-spiro[3a,6,7,8,8a,8b-hexahydropyrrolo[3,4-a]pyrrolizine-4,3''-indoline]-1,2'',3-trione的分子式是什么?
(3aR,4S,8aS,8bS)-2-benzyl-5''-chloro-7''-methyl-spiro[3a,6,7,8,8a,8b-hexahydropyrrolo[3,4-a]pyrrolizine-4,3''-indoline]-1,2'',3-trione的分子式为C24H22ClN3O3。
(3aR,4S,8aS,8bS)-2-benzyl-5''-chloro-7''-methyl-spiro[3a,6,7,8,8a,8b-hexahydropyrrolo[3,4-a]pyrrolizine-4,3''-indoline]-1,2'',3-trione的分子量是多少?
(3aR,4S,8aS,8bS)-2-benzyl-5''-chloro-7''-methyl-spiro[3a,6,7,8,8a,8b-hexahydropyrrolo[3,4-a]pyrrolizine-4,3''-indoline]-1,2'',3-trione的分子量为435.13 g/mol。
在哪里可以购买(3aR,4S,8aS,8bS)-2-benzyl-5''-chloro-7''-methyl-spiro[3a,6,7,8,8a,8b-hexahydropyrrolo[3,4-a]pyrrolizine-4,3''-indoline]-1,2'',3-trione?
您可以直接向科弘生物询价(3aR,4S,8aS,8bS)-2-benzyl-5''-chloro-7''-methyl-spiro[3a,6,7,8,8a,8b-hexahydropyrrolo[3,4-a]pyrrolizine-4,3''-indoline]-1,2'',3-trione。联系我们或发送邮件至info@kehongbio.com获取报价和库存信息。
科弘生物是否提供(3aR,4S,8aS,8bS)-2-benzyl-5''-chloro-7''-methyl-spiro[3a,6,7,8,8a,8b-hexahydropyrrolo[3,4-a]pyrrolizine-4,3''-indoline]-1,2'',3-trione的定制合成服务?
是的,科弘生物提供(3aR,4S,8aS,8bS)-2-benzyl-5''-chloro-7''-methyl-spiro[3a,6,7,8,8a,8b-hexahydropyrrolo[3,4-a]pyrrolizine-4,3''-indoline]-1,2'',3-trione及相关化合物的定制合成服务。请联系我们并告知您的具体需求,包括数量、纯度和交期。