((1-(5-(2-Chloroethyl)-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)-2-deoxy-beta-D-erythro-pentofuranos-5-yl)-oxy)(phenylamino)phosphinecarboxylic acid ethyl ester oxide structure

((1-(5-(2-Chloroethyl)-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)-2-deoxy-beta-D-erythro-pentofuranos-5-yl)-oxy)(phenylamino)phosphinecarboxylic acid ethyl ester oxide

概要:((1-(5-(2-Chloroethyl)-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)-2-deoxy-beta-D-erythro-pentofuranos-5-yl)-oxy)(phenylamino)phosphinecarboxylic acid ethyl ester oxide(CAS 115365-40-7)是一种化学化合物,分子式为C21H27ClN3O8P,分子量为515.12 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。

ethyl 2-[anilino-[[(2R,3S,5R)-5-[5-(2-chloroethyl)-2,4-dioxopyrimidin-1-yl]-3-hydroxyoxolan-2-yl]methoxy]phosphoryl]acetate

又称:((1-(5-(2-Chloroethyl)-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)-2-deoxy-beta-D-erythro-pentofuranos-5-yl)-oxy)(phenylamino)phosphinecarboxylic acid ethyl ester oxide, [[1-[5-(2-Chloroethyl)-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl]-2-deoxy-Beta-D-erythro-pentofuranos-5-yl]-oxy](phenylamino)phosphinecarboxylic acid ethyl ester oxide, 1-{5-O-[Anilino(2-ethoxy-2-oxoethyl)phosphoryl]-2-deoxy-beta-D-erythro-pentofuranosyl}-5-(2-chloroethyl)-4-hydroxypyrimidin-2(1H)-one, 1-{5-O-[Anilino(2-ethoxy-2-oxoethyl)phosphoryl]-2-deoxypentofuranosyl}-5-(2-chloroethyl)-4-hydroxypyrimidin-2(1H)-one, ethyl 2-[anilino-[[(2R,3S,5R)-5-[5-(2-chloroethyl)-2,4-dioxo-pyrimidin-1-yl]-3-hydroxy-tetrahydrofuran-2-yl]methoxy]phosphoryl]acetate

CAS: 115365-40-7
分子式 C21H27ClN3O8P
分子量 515.12 g/mol
LogP 1.8512
拓扑极性表面积 148.95 Ų
氢键供体数 3
氢键受体数 8
可旋转键数 11
精确质量 515.12244
重原子数 34
复杂度 1138.8287

化学标识符

CAS 编号 115365-40-7
SMILES CCOC(=O)CP(=O)(NC1=CC=CC=C1)OC[C@@H]2[C@H](C[C@@H](O2)N3C=C(C(=O)NC3=O)CCCl)O

产品概述

((1-(5-(2-Chloroethyl)-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)-2-deoxy-beta-D-erythro-pentofuranos-5-yl)-oxy)(phenylamino)phosphinecarboxylic acid ethyl ester oxide(CAS 115365-40-7),分子式为C21H27ClN3O8P,分子量为515.12 g/mol。IUPAC名:ethyl 2-[anilino-[[(2R,3S,5R)-5-[5-(2-chloroethyl)-2,4-dioxopyrimidin-1-yl]-3-hydroxyoxolan-2-yl]methoxy]phosphoryl]acetate

🧪
安全数据表(MSDS / SDS) 在PubChem上查看实验室化学品安全摘要(LCSS)——包含GHS分类、危险说明、急救措施和操作注意事项。
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((1-(5-(2-Chloroethyl)-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)-2-deoxy-beta-D-erythro-pentofuranos-5-yl)-oxy)(phenylamino)phosphinecarboxylic acid ethyl ester oxide化学性质概览

XLogP(分配系数)
1.8512
TPSA(拓扑极性表面积)
148.95
氢键供体数
3
氢键受体数
8
可旋转键数
11
重原子数
34
复杂度
1138.8287
精确质量
515.12244
单同位素质量
515.12244
数据来源: 化学性质数据引用自 PubChem,由美国国家医学图书馆(NLM)下属的国家生物技术信息中心(NCBI)维护的全球最大开放化学数据库。

属性洞察:((1-(5-(2-Chloroethyl)-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)-2-deoxy-beta-D-erythro-pentofuranos-5-yl)-oxy)(phenylamino)phosphinecarboxylic acid ethyl ester oxide

((1-(5-(2-Chloroethyl)-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)-2-deoxy-beta-D-erythro-pentofuranos-5-yl)-oxy)(phenylamino)phosphinecarboxylic acid ethyl ester oxide的XLogP值为1.8512,表明具有中等亲脂性,在水溶性和膜透过性之间取得平衡。 TPSA为148.95 Ų,极性较高,提示该化合物膜透过性可能受限但水溶性较好。 根据Lipinski五规则,((1-(5-(2-Chloroethyl)-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)-2-deoxy-beta-D-erythro-pentofuranos-5-yl)-oxy)(phenylamino)phosphinecarboxylic acid ethyl ester oxide有3个氢键供体和8个氢键受体,可能需要考虑配方优化。

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常见问题

((1-(5-(2-Chloroethyl)-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)-2-deoxy-beta-D-erythro-pentofuranos-5-yl)-oxy)(phenylamino)phosphinecarboxylic acid ethyl ester oxide的CAS号是多少?

((1-(5-(2-Chloroethyl)-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)-2-deoxy-beta-D-erythro-pentofuranos-5-yl)-oxy)(phenylamino)phosphinecarboxylic acid ethyl ester oxide的CAS号为115365-40-7。

((1-(5-(2-Chloroethyl)-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)-2-deoxy-beta-D-erythro-pentofuranos-5-yl)-oxy)(phenylamino)phosphinecarboxylic acid ethyl ester oxide的分子式是什么?

((1-(5-(2-Chloroethyl)-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)-2-deoxy-beta-D-erythro-pentofuranos-5-yl)-oxy)(phenylamino)phosphinecarboxylic acid ethyl ester oxide的分子式为C21H27ClN3O8P。

((1-(5-(2-Chloroethyl)-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)-2-deoxy-beta-D-erythro-pentofuranos-5-yl)-oxy)(phenylamino)phosphinecarboxylic acid ethyl ester oxide的分子量是多少?

((1-(5-(2-Chloroethyl)-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)-2-deoxy-beta-D-erythro-pentofuranos-5-yl)-oxy)(phenylamino)phosphinecarboxylic acid ethyl ester oxide的分子量为515.12 g/mol。

在哪里可以购买((1-(5-(2-Chloroethyl)-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)-2-deoxy-beta-D-erythro-pentofuranos-5-yl)-oxy)(phenylamino)phosphinecarboxylic acid ethyl ester oxide?

您可以直接向科弘生物询价((1-(5-(2-Chloroethyl)-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)-2-deoxy-beta-D-erythro-pentofuranos-5-yl)-oxy)(phenylamino)phosphinecarboxylic acid ethyl ester oxide。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((1-(5-(2-Chloroethyl)-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)-2-deoxy-beta-D-erythro-pentofuranos-5-yl)-oxy)(phenylamino)phosphinecarboxylic acid ethyl ester oxide的定制合成服务?

是的,科弘生物提供((1-(5-(2-Chloroethyl)-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)-2-deoxy-beta-D-erythro-pentofuranos-5-yl)-oxy)(phenylamino)phosphinecarboxylic acid ethyl ester oxide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。

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